Homo sapiens

ncbi_taxid: 9606 - Homo sapiens(species); all_childs: 63221, 741158

taxonomy name: Homo sapiens (species)
ancestor: Homo (genus)

Child Taxonomy

taxonomy name rank note
Homo sapiens neanderthalensis subspecies ncbi_taxid: 63221 - Homo sapiens neanderthalensis(subspecies); all_childs:
Homo sapiens subsp. 'Denisova' subspecies ncbi_taxid: 741158 - Homo sapiens subsp. 'Denisova'(subspecies); all_childs:

Enzyme Proteins

protein id name ec_number function

Metabolites

LCMS Annotations
Literature Annotations
Metabolite Database Reference Structure
Retinyl palmitate

Formula: C36H60O2
Exact Mass: 524.4593
Source ID: CNP0108720.0
  • CAS Registry: 79-81-2
  • KEGG: C02588
  • LipidMAPS: LMPR01090013
  • BioCYC: CHOCOLA_A
9-cis-Retinoic acid

Formula: C20H28O2
Exact Mass: 300.2089
Source ID: CNP0209779.0
  • CAS Registry: 5300-03-8
  • KEGG: C15493
  • LipidMAPS: LMPR01090022
  • BioCYC:
11-cis-Retinol

Formula: C20H30O
Exact Mass: 286.2297
Source ID: CNP0254958.0
  • CAS Registry: 22737-96-8
  • KEGG: C00899
  • LipidMAPS: LMPR01090005
  • BioCYC:
beta-Carotene

Formula: C40H56
Exact Mass: 536.4382
Source ID: CNP0233748.0
  • CAS Registry: 7235-40-7
  • KEGG: C02094
  • LipidMAPS: LMPR01070001
  • BioCYC: CPD1F-129
Prostaglandin F2alpha

Formula: C20H34O5
Exact Mass: 354.2406
Source ID: CNP0248684.1
  • CAS Registry: 551-11-1
  • KEGG: C00639
  • LipidMAPS: LMFA03010002
  • BioCYC: 5Z13E-15S-9-ALPHA11-ALPHA15-TRIHY
Cholic acid

Formula: C24H40O5
Exact Mass: 408.2876
Source ID: CNP0347795.1
  • CAS Registry: 81-25-4
  • KEGG: C00695
  • LipidMAPS: LMST04010001
  • BioCYC: CHOLATE
Calcidiol

Formula: C27H44O2
Exact Mass: 400.3341
Source ID: CNP0261058.1
  • CAS Registry: 19356-17-3
  • KEGG: C01561
  • LipidMAPS: LMST03020246
  • BioCYC: CALCIDIOL
Digoxin

Formula: C41H64O14
Exact Mass: 780.4296
Source ID: CNP0166169.1
  • CAS Registry: 20830-75-5
  • KEGG: C06956
  • LipidMAPS: LMST01120023
  • BioCYC: CPD-22580
Paclitaxel

Formula: C47H51NO14
Exact Mass: 853.3309
Source ID: CNP0567682.1
  • CAS Registry: 33069-62-4
  • KEGG: C07394
  • LipidMAPS: LMPR0104390001
  • BioCYC: CPD-8718
Orotate

Formula: C5H4N2O4
Exact Mass: 156.0171
Source ID: CNP0403686.0
  • CAS Registry: 65-86-1
  • KEGG: C00295
  • LipidMAPS:
  • BioCYC: OROTATE
Protoporphyrin

Formula: C34H34N4O4
Exact Mass: 562.258
Source ID: CNP0252744.0
  • CAS Registry: 553-12-8
  • KEGG: C02191
  • LipidMAPS:
  • BioCYC: PROTOPORPHYRIN_IX
Chenodeoxycholate

Formula: C24H40O4
Exact Mass: 392.2926
Source ID: CNP0224402.1
  • CAS Registry: 474-25-9
  • KEGG: C02528
  • LipidMAPS: LMST04010032
  • BioCYC:
D-Xylose

Formula: C5H10O5
Exact Mass: 150.0528
Source ID: CNP0207148.1
  • CAS Registry: 58-86-6
  • KEGG: C00181
  • LipidMAPS:
  • BioCYC: D-Xylose
glucarolactone

Formula: C6H10O6
Exact Mass: 178.0477
Source ID: CNP0122154.1
  • CAS Registry: 90-80-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Alprostadil

Formula: C20H34O5
Exact Mass: 354.2406
Source ID: CNP0260229.1
  • CAS Registry: 745-65-3
  • KEGG: C04741
  • LipidMAPS: LMFA03010134
  • BioCYC:
Progesterone

Formula: C21H30O2
Exact Mass: 314.2246
Source ID: CNP0364236.1
  • CAS Registry: 57-83-0
  • KEGG: C00410
  • LipidMAPS: LMST02030159
  • BioCYC: PROGESTERONE
Estradiol-17beta

Formula: C18H24O2
Exact Mass: 272.1776
Source ID: CNP0218249.1
  • CAS Registry: 50-28-2
  • KEGG: C00951
  • LipidMAPS: LMST02010001
  • BioCYC:
Ethinyl estradiol

Formula: C20H24O2
Exact Mass: 296.1776
Source ID: CNP0261935.1
  • CAS Registry: 57-63-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Androstenediol

Formula: C19H30O2
Exact Mass: 290.2246
Source ID: CNP0294937.1
  • CAS Registry: 521-17-5
  • KEGG: C04295
  • LipidMAPS: LMST02020005
  • BioCYC: CPD-23957
Cholesterol

Formula: C27H46O
Exact Mass: 386.3548
Source ID: CNP0174859.1
  • CAS Registry: 57-88-5
  • KEGG: C00187
  • LipidMAPS: LMST01010001
  • BioCYC: CHOLESTEROL
7-Dehydrocholesterol

Formula: C27H44O
Exact Mass: 384.3392
Source ID: CNP0117742.1
  • CAS Registry: 434-16-2
  • KEGG: C01164
  • LipidMAPS: LMST01010069
  • BioCYC: CPD-4187
11-Deoxycortisol

Formula: C21H30O4
Exact Mass: 346.2144
Source ID: CNP0312178.1
  • CAS Registry: 152-58-9
  • KEGG: C05488
  • LipidMAPS: LMST02030086
  • BioCYC: 11-DEOXY-CORTISOL
Dehydroepiandrosterone sulfate

Formula: C19H28O5S
Exact Mass: 368.1657
Source ID: CNP0178761.1
  • CAS Registry: 651-48-9
  • KEGG: C04555
  • LipidMAPS: LMST05020010
  • BioCYC: DEHYDRO-EPIANDROSTERONE-SULFATE
alpha-D-Galactose

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0210547.1
  • CAS Registry: 3646-73-9
  • KEGG: C00984
  • LipidMAPS:
  • BioCYC: ALPHA-D-GALACTOSE
beta-D-Glucose

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0210547.2
  • CAS Registry: 492-61-5
  • KEGG: C00221
  • LipidMAPS:
  • BioCYC: GLC
D-Glucose

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0210547.4
  • CAS Registry: 50-99-7
  • KEGG: C00031
  • LipidMAPS:
  • BioCYC: D-Glucose
16b-Hydroxyestradiol

Formula: C18H24O3
Exact Mass: 288.1725
Source ID: CNP0216041.1
  • CAS Registry: 547-81-9
  • KEGG:
  • LipidMAPS: LMST02010006
  • BioCYC:
Estrone

Formula: C18H22O2
Exact Mass: 270.162
Source ID: CNP0395406.1
  • CAS Registry: 53-16-7
  • KEGG: C00468
  • LipidMAPS: LMST02010004
  • BioCYC: ESTRONE
Vitamin D2

Formula: C28H44O
Exact Mass: 396.3392
Source ID: CNP0114577.1
  • CAS Registry: 50-14-6
  • KEGG: C05441
  • LipidMAPS: LMST03010001
  • BioCYC: VITAMIN_D2
Pregnanediol

Formula: C21H36O2
Exact Mass: 320.2715
Source ID: CNP0222135.1
  • CAS Registry: 80-92-2
  • KEGG: C05484
  • LipidMAPS: LMST02030202
  • BioCYC: PREGNANEDIOL
Hyodeoxycholic acid

Formula: C24H40O4
Exact Mass: 392.2926
Source ID: CNP0188776.1
  • CAS Registry: 83-49-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
S-Adenosyl-L-methionine

Formula: C15H22N6O5S
Exact Mass: 398.1372
Source ID: CNP0328281.1
  • CAS Registry: 29908-03-0
  • KEGG: C00019
  • LipidMAPS:
  • BioCYC:
Epidihydrocholesterin

Formula: C27H48O
Exact Mass: 388.3705
Source ID: CNP0188747.1
  • CAS Registry: 516-95-0
  • KEGG: C12978
  • LipidMAPS: LMST01010098
  • BioCYC: CPD-7193
Lactulose

Formula: C12H22O11
Exact Mass: 342.1162
Source ID: CNP0258592.1
  • CAS Registry: 4618-18-2
  • KEGG: C07064
  • LipidMAPS:
  • BioCYC: CPD-3561
Allopregnanolone

Formula: C21H34O2
Exact Mass: 318.2559
Source ID: CNP0198649.1
  • CAS Registry: 516-54-1
  • KEGG: C13712
  • LipidMAPS: LMST02030130
  • BioCYC: 3-BETA-HYDROXY-5-ALPHA-PREGNANE-20-ONE
Cortisol

Formula: C21H30O5
Exact Mass: 362.2093
Source ID: CNP0197063.1
  • CAS Registry: 50-23-7
  • KEGG: C00735
  • LipidMAPS: LMST02030001
  • BioCYC: CORTISOL
Estriol

Formula: C18H24O3
Exact Mass: 288.1725
Source ID: CNP0216041.2
  • CAS Registry: 50-27-1
  • KEGG: C05141
  • LipidMAPS: LMST02010003
  • BioCYC: ESTRIOL
Ascorbic acid

Formula: C6H8O6
Exact Mass: 176.0321
Source ID: CNP0367758.1
  • CAS Registry: 50-81-7
  • KEGG: C01041
  • LipidMAPS:
  • BioCYC:
Sucrose

Formula: C12H22O11
Exact Mass: 342.1162
Source ID: CNP0208561.1
  • CAS Registry: 57-50-1
  • KEGG: C00089
  • LipidMAPS:
  • BioCYC: SUCROSE
Estrone 3-sulfate

Formula: C18H22O5S
Exact Mass: 350.1188
Source ID: CNP0274514.2
  • CAS Registry: 481-97-0
  • KEGG: C02538
  • LipidMAPS: LMST02010043
  • BioCYC:
Caffeine

Formula: C8H10N4O2
Exact Mass: 194.0804
Source ID: CNP0228556.0
  • CAS Registry: 58-08-2
  • KEGG: C07481
  • LipidMAPS:
  • BioCYC: 1-3-7-TRIMETHYLXANTHINE
Codeine

Formula: C18H21NO3
Exact Mass: 299.1521
Source ID: CNP0247089.3
  • CAS Registry: 76-57-3
  • KEGG: C06174
  • LipidMAPS:
  • BioCYC:
Adenosine

Formula: C10H13N5O4
Exact Mass: 267.0967
Source ID: CNP0216822.2
  • CAS Registry: 58-61-7
  • KEGG: C00212
  • LipidMAPS:
  • BioCYC: ADENOSINE
Yohimbine

Formula: C21H26N2O3
Exact Mass: 354.1943
Source ID: CNP0305326.1
  • CAS Registry: 146-48-5
  • KEGG: C09256
  • LipidMAPS:
  • BioCYC: CPD-21567
Androstenedione

Formula: C19H26O2
Exact Mass: 286.1933
Source ID: CNP0378301.1
  • CAS Registry: 63-05-8
  • KEGG: C00280
  • LipidMAPS: LMST02020007
  • BioCYC: ANDROST4ENE
Dehydroepiandrosterone

Formula: C19H28O2
Exact Mass: 288.2089
Source ID: CNP0168236.1
  • CAS Registry: 53-43-0
  • KEGG: C01227
  • LipidMAPS: LMST02020021
  • BioCYC: 3-BETA-HYDROXYANDROST-5-EN-17-ONE
Estradiol-17alpha

Formula: C18H24O2
Exact Mass: 272.1776
Source ID: CNP0218249.2
  • CAS Registry: 57-91-0
  • KEGG: C02537
  • LipidMAPS: LMST02010029
  • BioCYC: CPD-351
AMP

Formula: C10H14N5O7P
Exact Mass: 347.0631
Source ID: CNP0216781.2
  • CAS Registry: 61-19-8
  • KEGG: C00020
  • LipidMAPS:
  • BioCYC: AMP
Fructose-1,6-diphosphate

Formula: C6H14O12P2
Exact Mass: 339.9961
Source ID: CNP0308307.3
  • CAS Registry: 34693-23-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
ATP

Formula: C10H16N5O13P3
Exact Mass: 506.9957
Source ID: CNP0223347.2
  • CAS Registry: 56-65-5
  • KEGG: C00002
  • LipidMAPS:
  • BioCYC:
Prostaglandin E2

Formula: C20H32O5
Exact Mass: 352.225
Source ID: CNP0410482.1
  • CAS Registry: 363-24-6
  • KEGG: C00584
  • LipidMAPS: LMFA03010148
  • BioCYC:
Allopregnanolone

Formula: C21H34O2
Exact Mass: 318.2559
Source ID: CNP0198649.2
  • CAS Registry: 516-54-1
  • KEGG: C13712
  • LipidMAPS: LMST02030130
  • BioCYC: 3-BETA-HYDROXY-5-ALPHA-PREGNANE-20-ONE
Testosterone

Formula: C19H28O2
Exact Mass: 288.2089
Source ID: CNP0201721.1
  • CAS Registry: 58-22-0
  • KEGG: C00535
  • LipidMAPS: LMST02020002
  • BioCYC: TESTOSTERONE
Ursodiol

Formula: C24H40O4
Exact Mass: 392.2926
Source ID: CNP0224402.2
  • CAS Registry: 128-13-2
  • KEGG: C07880
  • LipidMAPS: LMST04010039
  • BioCYC:
Deoxycholic acid

Formula: C24H40O4
Exact Mass: 392.2926
Source ID: CNP0207602.1
  • CAS Registry: 83-44-3
  • KEGG: C04483
  • LipidMAPS: LMST04010040
  • BioCYC:
Aldosterone

Formula: C21H28O5
Exact Mass: 360.1937
Source ID: CNP0202085.1
  • CAS Registry: 52-39-1
  • KEGG: C01780
  • LipidMAPS: LMST02030026
  • BioCYC: ALDOSTERONE
Simvastatin

Formula: C25H38O5
Exact Mass: 418.2719
Source ID: CNP0267824.1
  • CAS Registry: 79902-63-9
  • KEGG: D00434
  • LipidMAPS:
  • BioCYC: CPD66-17
trehalose

Formula: C12H22O11
Exact Mass: 342.1162
Source ID: CNP0217590.1
  • CAS Registry: 6138-23-4
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-15990
4-Hydroxybenzaldehyde

Formula: C7H6O2
Exact Mass: 122.0368
Source ID: CNP0230702.0
  • CAS Registry: 123-08-0
  • KEGG: C00633
  • LipidMAPS:
  • BioCYC: 4-HYDROXYBENZALDEHYDE
Chlorogenate

Formula: C16H18O9
Exact Mass: 354.0951
Source ID: CNP0148557.1
  • CAS Registry: 327-97-9
  • KEGG: C00852
  • LipidMAPS:
  • BioCYC: CAFFEOYLQUINATE
beta-Sitosterol

Formula: C29H50O
Exact Mass: 414.3861
Source ID: CNP0236620.1
  • CAS Registry: 83-46-5
  • KEGG: C01753
  • LipidMAPS: LMST01040129
  • BioCYC: CPD-4143
Thymol

Formula: C10H14O
Exact Mass: 150.1045
Source ID: CNP0135128.0
  • CAS Registry: 89-83-8
  • KEGG: C09908
  • LipidMAPS: LMPR0102090029
  • BioCYC:
Isorhamnetin

Formula: C16H12O7
Exact Mass: 316.0583
Source ID: CNP0304008.0
  • CAS Registry: 480-19-3
  • KEGG: C10084
  • LipidMAPS: LMPK12110002
  • BioCYC: CPD-8004
Kaempferol

Formula: C15H10O6
Exact Mass: 286.0477
Source ID: CNP0292269.0
  • CAS Registry: 520-18-3
  • KEGG: C05903
  • LipidMAPS: LMPK12110003
  • BioCYC: CPD1F-90
Quercetin

Formula: C15H10O7
Exact Mass: 302.0427
Source ID: CNP0103504.0
  • CAS Registry: 117-39-5
  • KEGG: C00389
  • LipidMAPS: LMPK12110004
  • BioCYC: CPD-520
Ferulate

Formula: C10H10O4
Exact Mass: 194.0579
Source ID: CNP0304940.0
  • CAS Registry: 537-98-4
  • KEGG: C01494
  • LipidMAPS:
  • BioCYC: FERULIC-ACID
Umbelliferone

Formula: C9H6O3
Exact Mass: 162.0317
Source ID: CNP0291283.0
  • CAS Registry: 93-35-6
  • KEGG: C09315
  • LipidMAPS:
  • BioCYC: CPD-8186
Gallate

Formula: C7H6O5
Exact Mass: 170.0215
Source ID: CNP0133244.0
  • CAS Registry: 149-91-7
  • KEGG: C01424
  • LipidMAPS:
  • BioCYC: CPD-183
Phloroglucinol

Formula: C6H6O3
Exact Mass: 126.0317
Source ID: CNP0299558.0
  • CAS Registry: 108-73-6
  • KEGG: C02183
  • LipidMAPS:
  • BioCYC: CPD-16
Caffeate

Formula: C9H8O4
Exact Mass: 180.0423
Source ID: CNP0186784.0
  • CAS Registry: 331-39-5
  • KEGG: C01481
  • LipidMAPS:
  • BioCYC: CPD-8098
4-Coumarate

Formula: C9H8O3
Exact Mass: 164.0473
Source ID: CNP0255341.0
  • CAS Registry: 7400-08-0
  • KEGG: C00811
  • LipidMAPS:
  • BioCYC:
2-Methoxybenzoic acid

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0156098.0
  • CAS Registry: 579-75-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(-)-Epicatechin

Formula: C15H14O6
Exact Mass: 290.079
Source ID: CNP0293352.2
  • CAS Registry: 490-46-0
  • KEGG: C09727
  • LipidMAPS: LMPK12020003
  • BioCYC: CPD-7630
Apigenin

Formula: C15H10O5
Exact Mass: 270.0528
Source ID: CNP0251015.0
  • CAS Registry: 520-36-5
  • KEGG: C01477
  • LipidMAPS: LMPK12110005
  • BioCYC: CPD-431
4-Hydroxyphenylethanol

Formula: C8H10O2
Exact Mass: 138.0681
Source ID: CNP0160217.0
  • CAS Registry: 501-94-0
  • KEGG: C06044
  • LipidMAPS:
  • BioCYC: CPD3O-4151
Ergosterol

Formula: C28H44O
Exact Mass: 396.3392
Source ID: CNP0274636.1
  • CAS Registry: 57-87-4
  • KEGG: C01694
  • LipidMAPS: LMST01030093
  • BioCYC: ERGOSTEROL
Methylparaben

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0259416.0
  • CAS Registry: 99-76-3
  • KEGG: D01400
  • LipidMAPS:
  • BioCYC: CPD-18691
4-Hydroxyphenylacetate

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0212603.0
  • CAS Registry: 156-38-7
  • KEGG: C00642
  • LipidMAPS:
  • BioCYC: 4-HYDROXYPHENYLACETATE
Elemicin

Formula: C12H16O3
Exact Mass: 208.1099
Source ID: CNP0286854.0
  • CAS Registry: 487-11-6
  • KEGG: C10451
  • LipidMAPS:
  • BioCYC:
4-Hydroxybenzoate

Formula: C7H6O3
Exact Mass: 138.0317
Source ID: CNP0253685.0
  • CAS Registry: 99-96-7
  • KEGG: C00156
  • LipidMAPS:
  • BioCYC:
L-Phenylalanine

Formula: C9H11NO2
Exact Mass: 165.079
Source ID: CNP0193965.1
  • CAS Registry: 63-91-2
  • KEGG: C00079
  • LipidMAPS:
  • BioCYC: PHE
trans-Cinnamate

Formula: C9H8O2
Exact Mass: 148.0524
Source ID: CNP0390407.0
  • CAS Registry: 140-10-3
  • KEGG: C00423
  • LipidMAPS:
  • BioCYC:
Salicylate

Formula: C7H6O3
Exact Mass: 138.0317
Source ID: CNP0230203.0
  • CAS Registry: 69-72-7
  • KEGG: C00805
  • LipidMAPS:
  • BioCYC: CPD-110
Vanillate

Formula: C8H8O4
Exact Mass: 168.0423
Source ID: CNP0122021.0
  • CAS Registry: 121-34-6
  • KEGG: C06672
  • LipidMAPS:
  • BioCYC:
4-Hydroxy-3-methoxy-benzaldehyde

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0270199.0
  • CAS Registry: 121-33-5
  • KEGG: C00755
  • LipidMAPS:
  • BioCYC: VANILLIN
4-Methoxybenzoate

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0249583.0
  • CAS Registry: 100-09-4
  • KEGG: C02519
  • LipidMAPS:
  • BioCYC: CPD-1076
Hexadecanoic acid

Formula: C16H32O2
Exact Mass: 256.2402
Source ID: CNP0420987.0
  • CAS Registry: 57-10-3
  • KEGG: C00249
  • LipidMAPS: LMFA01010001
  • BioCYC: PALMITATE
Aromatic aldehyde

Formula: C7H6O
Exact Mass: 106.0419
Source ID: CNP0105179.0
  • CAS Registry: 100-52-7
  • KEGG: C00193
  • LipidMAPS:
  • BioCYC: BENZALDEHYDE
Coumarin

Formula: C9H6O2
Exact Mass: 146.0368
Source ID: CNP0225025.0
  • CAS Registry: 91-64-5
  • KEGG: C05851
  • LipidMAPS:
  • BioCYC: COUMARIN
Benzamide

Formula: C7H7NO
Exact Mass: 121.0528
Source ID: CNP0225623.0
  • CAS Registry: 55-21-0
  • KEGG: C09815
  • LipidMAPS:
  • BioCYC: CPD-17683
Diphenhydramine

Formula: C17H21NO
Exact Mass: 255.1623
Source ID: CNP0339645.0
  • CAS Registry: 58-73-1
  • KEGG: C06960
  • LipidMAPS:
  • BioCYC: CPD-10890
Allyl isothiocyanate

Formula: C4H5NS
Exact Mass: 99.0143
Source ID: CNP0329428.0
  • CAS Registry: 57-06-7
  • KEGG: C19317
  • LipidMAPS:
  • BioCYC: CPD-19501
Saccharin

Formula: C7H5NO3S
Exact Mass: 182.999
Source ID: CNP0151101.0
  • CAS Registry: 81-07-2
  • KEGG: C12283
  • LipidMAPS:
  • BioCYC: CPD-5581
Methyl acetate

Formula: C3H6O2
Exact Mass: 74.0368
Source ID: CNP0578880.0
  • CAS Registry: 79-20-9
  • KEGG: C17530
  • LipidMAPS:
  • BioCYC: METHYL-ACETATE
2-Methoxy-4-methylphenol

Formula: C8H10O2
Exact Mass: 138.0681
Source ID: CNP0264266.0
  • CAS Registry: 93-51-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
gamma-Terpinene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0255720.0
  • CAS Registry: 99-85-4
  • KEGG: C09900
  • LipidMAPS: LMPR0102090027
  • BioCYC: CPD-8736
alpha-Terpinene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0178656.0
  • CAS Registry: 99-86-5
  • KEGG: C09898
  • LipidMAPS: LMPR0102090026
  • BioCYC: CPD-8735
Propyl propionate

Formula: C6H12O2
Exact Mass: 116.0837
Source ID: CNP0296678.0
  • CAS Registry: 106-36-5
  • KEGG:
  • LipidMAPS: LMFA07010412
  • BioCYC:
Propyl acetate

Formula: C5H10O2
Exact Mass: 102.0681
Source ID: CNP0274142.0
  • CAS Registry: 109-60-4
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-18998
2-Octanone

Formula: C8H16O
Exact Mass: 128.1201
Source ID: CNP0325160.0
  • CAS Registry: 111-13-7
  • KEGG:
  • LipidMAPS: LMFA12000054
  • BioCYC: CPD-18988
1-Nonanol

Formula: C9H20O
Exact Mass: 144.1514
Source ID: CNP0307663.0
  • CAS Registry: 143-08-8
  • KEGG: C14696
  • LipidMAPS: LMFA05000092
  • BioCYC: CPD-23437
Sulcatone

Formula: C8H14O
Exact Mass: 126.1045
Source ID: CNP0330890.0
  • CAS Registry: 110-93-0
  • KEGG: C07287
  • LipidMAPS: LMFA12000039
  • BioCYC: CPD-7969
Propyl 3-methylbutanoate

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0105828.0
  • CAS Registry: 557-00-6
  • KEGG:
  • LipidMAPS: LMFA07011003
  • BioCYC:
Geraniol

Formula: C10H18O
Exact Mass: 154.1358
Source ID: CNP0244258.0
  • CAS Registry: 106-24-1
  • KEGG: C01500
  • LipidMAPS: LMPR0102010016
  • BioCYC: GERANIOL
Genistein

Formula: C15H10O5
Exact Mass: 270.0528
Source ID: CNP0174866.0
  • CAS Registry: 446-72-0
  • KEGG: C06563
  • LipidMAPS: LMPK12050218
  • BioCYC: CPD-3141
Daidzein

Formula: C15H10O4
Exact Mass: 254.0579
Source ID: CNP0190002.0
  • CAS Registry: 486-66-8
  • KEGG: C10208
  • LipidMAPS: LMPK12050038
  • BioCYC: DAIDZEIN
Berberine

Formula: C20H18NO4
Exact Mass: 336.1236
Source ID: CNP0108877.0
  • CAS Registry: 2086-83-1
  • KEGG: C00757
  • LipidMAPS:
  • BioCYC: BERBERINE
(+)-Catechin

Formula: C15H14O6
Exact Mass: 290.079
Source ID: CNP0293352.3
  • CAS Registry: 154-23-4
  • KEGG: C06562
  • LipidMAPS: LMPK12020001
  • BioCYC: CPD-1961
Hydrogen cyanide

Formula: CHN
Exact Mass: 27.0109
Source ID: CNP0572559.0
  • CAS Registry: 74-90-8
  • KEGG: C01326
  • LipidMAPS:
  • BioCYC: HCN
Coumestrol

Formula: C15H8O5
Exact Mass: 268.0372
Source ID: CNP0328371.0
  • CAS Registry: 479-13-0
  • KEGG: C10205
  • LipidMAPS: LMPK12090018
  • BioCYC: CPD-11779
L-Tryptophan

Formula: C11H12N2O2
Exact Mass: 204.0899
Source ID: CNP0167976.1
  • CAS Registry: 73-22-3
  • KEGG: C00078
  • LipidMAPS:
  • BioCYC: TRP
Glycyl-leucine

Formula: C8H16N2O3
Exact Mass: 188.1161
Source ID: CNP0387937.1
  • CAS Registry: 869-19-2
  • KEGG: C02155
  • LipidMAPS:
  • BioCYC: CPD-12312
Glycyl-Phenylalanine

Formula: C11H14N2O3
Exact Mass: 222.1004
Source ID: CNP0209372.1
  • CAS Registry: 3321-03-7
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-20345
Myricetin

Formula: C15H10O8
Exact Mass: 318.0376
Source ID: CNP0105429.0
  • CAS Registry: 529-44-2
  • KEGG: C10107
  • LipidMAPS: LMPK12110001
  • BioCYC: MYRICETIN
Hesperetin

Formula: C16H14O6
Exact Mass: 302.079
Source ID: CNP0393256.1
  • CAS Registry: 520-33-2
  • KEGG: C01709
  • LipidMAPS: LMPK12140003
  • BioCYC: CPD-7072
Phloretin

Formula: C15H14O5
Exact Mass: 274.0841
Source ID: CNP0379475.0
  • CAS Registry: 60-82-2
  • KEGG: C00774
  • LipidMAPS: LMPK12120525
  • BioCYC: PHLORETIN
Biochanin A

Formula: C16H12O5
Exact Mass: 284.0685
Source ID: CNP0314566.0
  • CAS Registry: 491-80-5
  • KEGG: C00814
  • LipidMAPS: LMPK12050229
  • BioCYC: BIOCHANIN-A
Glycitein

Formula: C16H12O5
Exact Mass: 284.0685
Source ID: CNP0156838.0
  • CAS Registry: 40957-83-3
  • KEGG: C14536
  • LipidMAPS: LMPK12050104
  • BioCYC: CPD-7027
Formononetin

Formula: C16H12O4
Exact Mass: 268.0736
Source ID: CNP0225909.0
  • CAS Registry: 485-72-3
  • KEGG: C00858
  • LipidMAPS: LMPK12050037
  • BioCYC: FORMONONETIN
Antipyrine

Formula: C11H12N2O
Exact Mass: 188.095
Source ID: CNP0340599.0
  • CAS Registry: 60-80-0
  • KEGG: C13244
  • LipidMAPS:
  • BioCYC:
Piperidine

Formula: C5H11N
Exact Mass: 85.0891
Source ID: CNP0153358.0
  • CAS Registry: 110-89-4
  • KEGG: C01746
  • LipidMAPS:
  • BioCYC: PIPERIDINE
Linolenelaidic acid

Formula: C18H30O2
Exact Mass: 278.2246
Source ID: CNP0149780.0
  • CAS Registry: 28290-79-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Methylpyridine

Formula: C6H7N
Exact Mass: 93.0578
Source ID: CNP0137947.0
  • CAS Registry: 109-06-8
  • KEGG: C14447
  • LipidMAPS:
  • BioCYC:
Methyleugenol

Formula: C11H14O2
Exact Mass: 178.0994
Source ID: CNP0137352.0
  • CAS Registry: 93-15-2
  • KEGG: C10454
  • LipidMAPS:
  • BioCYC: CPD-6482
Acetophenone

Formula: C8H8O
Exact Mass: 120.0575
Source ID: CNP0296349.0
  • CAS Registry: 98-86-2
  • KEGG: C07113
  • LipidMAPS:
  • BioCYC: PHENYL
3-Methylbutyl propanoate

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0244888.0
  • CAS Registry: 105-68-0
  • KEGG:
  • LipidMAPS: LMFA07010573
  • BioCYC:
Benzyl acetate

Formula: C9H10O2
Exact Mass: 150.0681
Source ID: CNP0361944.0
  • CAS Registry: 140-11-4
  • KEGG: C15513
  • LipidMAPS:
  • BioCYC: CPD-6501
2-Methylpropyl propanoate

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0246924.0
  • CAS Registry: 540-42-1
  • KEGG:
  • LipidMAPS: LMFA07010567
  • BioCYC:
Isopropyl propionate

Formula: C6H12O2
Exact Mass: 116.0837
Source ID: CNP0250066.0
  • CAS Registry: 637-78-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isoamyl acetate

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0303079.0
  • CAS Registry: 123-92-2
  • KEGG: C12296
  • LipidMAPS:
  • BioCYC: CPD-19626
Geranial

Formula: C10H16O
Exact Mass: 152.1201
Source ID: CNP0127332.0
  • CAS Registry: 141-27-5
  • KEGG: C01499
  • LipidMAPS: LMPR0102010003
  • BioCYC: GERANIAL
Geranyl acetate

Formula: C12H20O2
Exact Mass: 196.1463
Source ID: CNP0301697.0
  • CAS Registry: 105-87-3
  • KEGG: C09861
  • LipidMAPS: LMFA07010189
  • BioCYC: CPD-9758
Phenylacetaldehyde

Formula: C8H8O
Exact Mass: 120.0575
Source ID: CNP0175320.0
  • CAS Registry: 122-78-1
  • KEGG: C00601
  • LipidMAPS:
  • BioCYC: PHENYLACETALDEHYDE
Taurine

Formula: C2H7NO3S
Exact Mass: 125.0147
Source ID: CNP0178735.0
  • CAS Registry: 107-35-7
  • KEGG: C00245
  • LipidMAPS:
  • BioCYC: TAURINE
Phenylethyl alcohol

Formula: C8H10O
Exact Mass: 122.0732
Source ID: CNP0402269.0
  • CAS Registry: 60-12-8
  • KEGG: C05853
  • LipidMAPS:
  • BioCYC: CPD-7035
L-Leucine

Formula: C6H13NO2
Exact Mass: 131.0946
Source ID: CNP0201141.1
  • CAS Registry: 61-90-5
  • KEGG: C00123
  • LipidMAPS:
  • BioCYC: LEU
Dimethyl sulfoxide

Formula: C2H6OS
Exact Mass: 78.0139
Source ID: CNP0499675.0
  • CAS Registry: 67-68-5
  • KEGG: C11143
  • LipidMAPS:
  • BioCYC: DMSO
Furfuryl alcohol

Formula: C5H6O2
Exact Mass: 98.0368
Source ID: CNP0152361.0
  • CAS Registry: 98-00-0
  • KEGG: C20441
  • LipidMAPS:
  • BioCYC: CPD-14102
Propan-2-ol

Formula: C3H8O
Exact Mass: 60.0575
Source ID: CNP0603430.0
  • CAS Registry: 67-63-0
  • KEGG: C01845
  • LipidMAPS:
  • BioCYC: ISO-PROPANOL
(E)-beta-Ocimene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0295010.0
  • CAS Registry: 3779-61-1
  • KEGG: C09873
  • LipidMAPS: LMPR0102010021
  • BioCYC: CPD-4889
Ubiquinone Q9;CoQ9;Ubiquinone 9

Formula: C54H82O4
Exact Mass: 794.6213
Source ID: CNP0133083.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
delta-Tocopherol

Formula: C27H46O2
Exact Mass: 402.3498
Source ID: CNP0376118.1
  • CAS Registry: 119-13-1
  • KEGG: C14151
  • LipidMAPS: LMPR02020066
  • BioCYC: DELTA-TOCOPHEROL
(Z)-p-Methoxycinnamic acid

Formula: C10H10O3
Exact Mass: 178.063
Source ID: CNP0250415.0
  • CAS Registry: 830-09-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-(Methylthio)-1-propene

Formula: C4H8S
Exact Mass: 88.0347
Source ID: CNP0572475.0
  • CAS Registry: 10152-76-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Guanidine

Formula: CH5N3
Exact Mass: 59.0483
Source ID: CNP0564001.0
  • CAS Registry: 113-00-8
  • KEGG: C17349
  • LipidMAPS:
  • BioCYC: CPD-13517
alpha-Tocopherol

Formula: C29H50O2
Exact Mass: 430.3811
Source ID: CNP0338526.1
  • CAS Registry: 59-02-9
  • KEGG: C02477
  • LipidMAPS: LMPR02020001
  • BioCYC: ALPHA-TOCOPHEROL
Phytofluene

Formula: C40H62
Exact Mass: 542.4851
Source ID: CNP0181593.0
  • CAS Registry: 27664-65-9
  • KEGG:
  • LipidMAPS: LMPR01070410
  • BioCYC:
Zeaxanthin

Formula: C40H56O2
Exact Mass: 568.428
Source ID: CNP0283320.1
  • CAS Registry: 144-68-3
  • KEGG: C06098
  • LipidMAPS: LMPR01070261
  • BioCYC: CPD1F-130
Trimethylamine

Formula: C3H9N
Exact Mass: 59.0735
Source ID: CNP0522907.0
  • CAS Registry: 75-50-3
  • KEGG: C00565
  • LipidMAPS:
  • BioCYC: TRIMETHYLAMINE
Dimethyl trisulfide

Formula: C2H6S3
Exact Mass: 125.9632
Source ID: CNP0486985.0
  • CAS Registry: 3658-80-8
  • KEGG: C08372
  • LipidMAPS:
  • BioCYC:
Choline

Formula: C5H14NO
Exact Mass: 104.1075
Source ID: CNP0161849.0
  • CAS Registry: 62-49-7
  • KEGG: C00114
  • LipidMAPS:
  • BioCYC: CHOLINE
3-Methylbutanol

Formula: C5H12O
Exact Mass: 88.0888
Source ID: CNP0115711.0
  • CAS Registry: 123-51-3
  • KEGG: C07328
  • LipidMAPS: LMFA05000108
  • BioCYC: CPD-7032
4-Aminobutanoate

Formula: C4H9NO2
Exact Mass: 103.0633
Source ID: CNP0116256.0
  • CAS Registry: 56-12-2
  • KEGG: C00334
  • LipidMAPS: LMFA01100039
  • BioCYC: 4-AMINO-BUTYRATE
Methylpyrazine

Formula: C5H6N2
Exact Mass: 94.0531
Source ID: CNP0285763.0
  • CAS Registry: 109-08-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
beta-Farnesene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0242426.0
  • CAS Registry: 18794-84-8
  • KEGG: C09666
  • LipidMAPS: LMFA11000040
  • BioCYC: CPD-8239
p-Tolualdehyde

Formula: C8H8O
Exact Mass: 120.0575
Source ID: CNP0234694.0
  • CAS Registry: 104-87-0
  • KEGG: C06758
  • LipidMAPS:
  • BioCYC: CPD-8773
Linoelaidic acid

Formula: C18H32O2
Exact Mass: 280.2402
Source ID: CNP0194582.0
  • CAS Registry: 506-21-8
  • KEGG:
  • LipidMAPS: LMFA01030123
  • BioCYC:
Anethole

Formula: C10H12O
Exact Mass: 148.0888
Source ID: CNP0402035.0
  • CAS Registry: 4180-23-8
  • KEGG: C10428
  • LipidMAPS:
  • BioCYC: CPD-9930
Fumarate

Formula: C4H4O4
Exact Mass: 116.011
Source ID: CNP0289193.0
  • CAS Registry: 110-17-8
  • KEGG: C00122
  • LipidMAPS:
  • BioCYC: FUM
Thiamine

Formula: C12H17N4OS
Exact Mass: 265.1123
Source ID: CNP0538996.0
  • CAS Registry: 70-16-6
  • KEGG: C00378
  • LipidMAPS:
  • BioCYC: THIAMINE
Sinapate

Formula: C11H12O5
Exact Mass: 224.0685
Source ID: CNP0195904.0
  • CAS Registry: 530-59-6
  • KEGG: C00482
  • LipidMAPS:
  • BioCYC:
Lycopene

Formula: C40H56
Exact Mass: 536.4382
Source ID: CNP0151679.0
  • CAS Registry: 502-65-8
  • KEGG: C05432
  • LipidMAPS: LMPR01070257
  • BioCYC: CPD1F-114
Methylguanidine

Formula: C2H7N3
Exact Mass: 73.064
Source ID: CNP0590894.0
  • CAS Registry: 471-29-4
  • KEGG: C02294
  • LipidMAPS:
  • BioCYC: CPD-593
Squalene

Formula: C30H50
Exact Mass: 410.3912
Source ID: CNP0183709.0
  • CAS Registry: 111-02-4
  • KEGG: C00751
  • LipidMAPS: LMPR0106010002
  • BioCYC: SQUALENE
Myristoleic acid

Formula: C14H26O2
Exact Mass: 226.1933
Source ID: CNP0275417.0
  • CAS Registry: 544-64-9
  • KEGG: C08322
  • LipidMAPS: LMFA01030051
  • BioCYC:
icosa-5,8,11,14-tetraenoic acid

Formula: C20H32O2
Exact Mass: 304.2402
Source ID: CNP0117763.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Octadeca-6,9,12-trienoic acid

Formula: C18H30O2
Exact Mass: 278.2246
Source ID: CNP0126011.0
  • CAS Registry: 506-26-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Pentanol

Formula: C5H12O
Exact Mass: 88.0888
Source ID: CNP0244882.0
  • CAS Registry: 71-41-0
  • KEGG: C16834
  • LipidMAPS: LMFA05000112
  • BioCYC: PENTANOL
S-Methyl-L-cysteine

Formula: C4H9NO2S
Exact Mass: 135.0354
Source ID: CNP0391530.1
  • CAS Registry: 1187-84-4
  • KEGG: C22040
  • LipidMAPS:
  • BioCYC:
beta-Damascenone

Formula: C13H18O
Exact Mass: 190.1358
Source ID: CNP0154955.0
  • CAS Registry: 23696-85-7
  • KEGG:
  • LipidMAPS: LMPR01070304
  • BioCYC:
alpha-Farnesene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0220187.0
  • CAS Registry: 502-61-4
  • KEGG: C09665
  • LipidMAPS:
  • BioCYC: CPD-8764
Indole-3-carboxylate

Formula: C9H7NO2
Exact Mass: 161.0477
Source ID: CNP0272837.0
  • CAS Registry: 771-50-6
  • KEGG: C19837
  • LipidMAPS:
  • BioCYC:
Methyl salicylate

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0320906.0
  • CAS Registry: 119-36-8
  • KEGG: C12305
  • LipidMAPS:
  • BioCYC: CPD-6442
beta-Ionone

Formula: C13H20O
Exact Mass: 192.1514
Source ID: CNP0261884.0
  • CAS Registry: 79-77-6
  • KEGG: C12287
  • LipidMAPS:
  • BioCYC: CPD-7204
Hordenine

Formula: C10H15NO
Exact Mass: 165.1154
Source ID: CNP0321554.0
  • CAS Registry: 539-15-1
  • KEGG: C06199
  • LipidMAPS:
  • BioCYC:
15-cis-Phytoene

Formula: C40H64
Exact Mass: 544.5008
Source ID: CNP0186582.0
  • CAS Registry: 13920-14-4
  • KEGG: C05421
  • LipidMAPS: LMPR01070255
  • BioCYC:
Cyclohexane

Formula: C6H12
Exact Mass: 84.0939
Source ID: CNP0220772.0
  • CAS Registry: 110-82-7
  • KEGG: C11249
  • LipidMAPS:
  • BioCYC: CPD-8923
L-Arginine

Formula: C6H14N4O2
Exact Mass: 174.1117
Source ID: CNP0257247.1
  • CAS Registry: 74-79-3
  • KEGG: C00062
  • LipidMAPS:
  • BioCYC: ARG
Guanidinoacetate

Formula: C3H7N3O2
Exact Mass: 117.0538
Source ID: CNP0177921.0
  • CAS Registry: 352-97-6
  • KEGG: C00581
  • LipidMAPS:
  • BioCYC: GUANIDOACETIC_ACID
N(pi)-Methyl-L-histidine

Formula: C7H11N3O2
Exact Mass: 169.0851
Source ID: CNP0255597.1
  • CAS Registry: 368-16-1
  • KEGG: C01152
  • LipidMAPS:
  • BioCYC:
L-Methionine

Formula: C5H11NO2S
Exact Mass: 149.051
Source ID: CNP0217457.1
  • CAS Registry: 63-68-3
  • KEGG: C00073
  • LipidMAPS:
  • BioCYC: MET
1-Propylamine

Formula: C3H9N
Exact Mass: 59.0735
Source ID: CNP0600530.0
  • CAS Registry: 107-10-8
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-9379
Aspartate

Formula: C4H7NO4
Exact Mass: 133.0375
Source ID: CNP0141839.1
  • CAS Registry: 617-45-8
  • KEGG: C16433
  • LipidMAPS:
  • BioCYC:
cis-Aconitate

Formula: C6H6O6
Exact Mass: 174.0164
Source ID: CNP0184949.0
  • CAS Registry: 585-84-2
  • KEGG: C00417
  • LipidMAPS:
  • BioCYC: CIS-ACONITATE
4-Guanidinobutanoate

Formula: C5H11N3O2
Exact Mass: 145.0851
Source ID: CNP0565409.0
  • CAS Registry: 463-00-3
  • KEGG: C01035
  • LipidMAPS:
  • BioCYC:
Pentanal

Formula: C5H10O
Exact Mass: 86.0732
Source ID: CNP0361186.0
  • CAS Registry: 110-62-3
  • KEGG:
  • LipidMAPS: LMFA06000251
  • BioCYC: CPD-9053
2,3-Di(octadec-9-enoyloxy)propyl octadec-9-enoate

Formula: C57H104O6
Exact Mass: 884.7832
Source ID: CNP0391404.0
  • CAS Registry: 122-32-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
tartaric acid

Formula: C4H6O6
Exact Mass: 150.0164
Source ID: CNP0131308.2
  • CAS Registry: 133-37-9
  • KEGG: C00898
  • LipidMAPS:
  • BioCYC:
Creatine

Formula: C4H9N3O2
Exact Mass: 131.0695
Source ID: CNP0156562.0
  • CAS Registry: 57-00-1
  • KEGG: C00300
  • LipidMAPS:
  • BioCYC: CREATINE
o-Cresol

Formula: C7H8O
Exact Mass: 108.0575
Source ID: CNP0242840.0
  • CAS Registry: 95-48-7
  • KEGG: C01542
  • LipidMAPS:
  • BioCYC: CPD-109
arabinonic acid

Formula: C5H10O6
Exact Mass: 166.0477
Source ID: CNP0348844.1
  • CAS Registry: 488-30-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Ellagic acid

Formula: C14H6O8
Exact Mass: 302.0063
Source ID: CNP0224900.0
  • CAS Registry: 476-66-4
  • KEGG: C10788
  • LipidMAPS:
  • BioCYC: CPD-17769
3,4-Dihydroxybenzaldehyde

Formula: C7H6O3
Exact Mass: 138.0317
Source ID: CNP0203672.0
  • CAS Registry: 139-85-5
  • KEGG: C16700
  • LipidMAPS:
  • BioCYC: CPD-7616
Prostaglandin A2

Formula: C20H30O4
Exact Mass: 334.2144
Source ID: CNP0267569.1
  • CAS Registry: 13345-50-1
  • KEGG: C05953
  • LipidMAPS: LMFA03010035
  • BioCYC:
Pimelate

Formula: C7H12O4
Exact Mass: 160.0736
Source ID: CNP0143018.0
  • CAS Registry: 111-16-0
  • KEGG: C02656
  • LipidMAPS: LMFA01170051
  • BioCYC: CPD-205
Dimethyl disulfide

Formula: C2H6S2
Exact Mass: 93.9911
Source ID: CNP0600942.0
  • CAS Registry: 624-92-0
  • KEGG: C08371
  • LipidMAPS:
  • BioCYC: CPD-19232
N,N-Dimethyltryptamine

Formula: C12H16N2
Exact Mass: 188.1313
Source ID: CNP0162089.0
  • CAS Registry: 61-50-7
  • KEGG: C08302
  • LipidMAPS:
  • BioCYC:
5-Methyl-2-furaldehyde

Formula: C6H6O2
Exact Mass: 110.0368
Source ID: CNP0142902.0
  • CAS Registry: 620-02-0
  • KEGG: C11115
  • LipidMAPS:
  • BioCYC:
Toluene

Formula: C7H8
Exact Mass: 92.0626
Source ID: CNP0156985.0
  • CAS Registry: 108-88-3
  • KEGG: C01455
  • LipidMAPS:
  • BioCYC: TOLUENE
beta-Cadinene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0308562.1
  • CAS Registry: 523-47-7
  • KEGG: C09625
  • LipidMAPS: LMPR0103330003
  • BioCYC:
Palmitelaidic acid

Formula: C16H30O2
Exact Mass: 254.2246
Source ID: CNP0307038.0
  • CAS Registry: 10030-73-6
  • KEGG:
  • LipidMAPS: LMFA01030057
  • BioCYC:
3-Hydroxy-3-methylglutarate

Formula: C6H10O5
Exact Mass: 162.0528
Source ID: CNP0185364.0
  • CAS Registry: 503-49-1
  • KEGG: C03761
  • LipidMAPS:
  • BioCYC: CPD-547
Dimethylamine

Formula: C2H7N
Exact Mass: 45.0578
Source ID: CNP0491602.0
  • CAS Registry: 124-40-3
  • KEGG: C00543
  • LipidMAPS:
  • BioCYC: DIMETHYLAMINE
2,5-Dimethylpyrazine

Formula: C6H8N2
Exact Mass: 108.0687
Source ID: CNP0257272.0
  • CAS Registry: 123-32-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Nonadecane

Formula: C19H40
Exact Mass: 268.313
Source ID: CNP0355992.0
  • CAS Registry: 629-92-5
  • KEGG:
  • LipidMAPS: LMFA11000578
  • BioCYC: CPD-7942
Hexadecane

Formula: C16H34
Exact Mass: 226.266
Source ID: CNP0250856.0
  • CAS Registry: 544-76-3
  • KEGG: C14499
  • LipidMAPS: LMFA11000577
  • BioCYC: CPD-8509
Dihydroxybenzoic acid

Formula: C7H6O4
Exact Mass: 154.0266
Source ID: CNP0283277.0
  • CAS Registry: 303-38-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Methylmalonate

Formula: C4H6O4
Exact Mass: 118.0266
Source ID: CNP0415806.0
  • CAS Registry: 516-05-2
  • KEGG: C02170
  • LipidMAPS: LMFA01170118
  • BioCYC: CPD-546
o-Xylene

Formula: C8H10
Exact Mass: 106.0782
Source ID: CNP0365784.0
  • CAS Registry: 95-47-6
  • KEGG: C07212
  • LipidMAPS:
  • BioCYC: CPD-1421
Cadaverine

Formula: C5H14N2
Exact Mass: 102.1157
Source ID: CNP0184259.0
  • CAS Registry: 462-94-2
  • KEGG: C01672
  • LipidMAPS:
  • BioCYC: CADAVERINE
(+)-gamma-Cadinene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0123983.1
  • CAS Registry: 483-74-9
  • KEGG: C20173
  • LipidMAPS:
  • BioCYC: CPD-8787
trans-2-Hydroxycinnamate

Formula: C9H8O3
Exact Mass: 164.0473
Source ID: CNP0207361.0
  • CAS Registry: 614-60-8
  • KEGG: C01772
  • LipidMAPS:
  • BioCYC:
D-Mannose

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0210547.6
  • CAS Registry: 3458-28-4
  • KEGG: C00159
  • LipidMAPS:
  • BioCYC: MANNOSE
Eicosa-5,8,11,14,17-pentaenoic acid

Formula: C20H30O2
Exact Mass: 302.2246
Source ID: CNP0214199.0
  • CAS Registry: 1553-41-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Octadecanoic acid

Formula: C18H36O2
Exact Mass: 284.2715
Source ID: CNP0396081.0
  • CAS Registry: 57-11-4
  • KEGG: C01530
  • LipidMAPS: LMFA01010018
  • BioCYC: STEARIC_ACID
(4E,7E,10Z,13E,16E,19E)-Docosa-4,7,10,13,16,19-hexaenoic acid

Formula: C22H32O2
Exact Mass: 328.2402
Source ID: CNP0165660.0
  • CAS Registry: 2091-24-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Dihydroxybenzoic acid

Formula: C7H6O4
Exact Mass: 154.0266
Source ID: CNP0348948.0
  • CAS Registry: 303-38-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Acetate

Formula: C2H4O2
Exact Mass: 60.0211
Source ID: CNP0495539.0
  • CAS Registry: 64-19-7
  • KEGG: C00033
  • LipidMAPS: LMFA01010002
  • BioCYC: ACET
Octadec-9-enoic Acid

Formula: C18H34O2
Exact Mass: 282.2559
Source ID: CNP0142072.0
  • CAS Registry: 2027-47-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Humulene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0263112.0
  • CAS Registry: 6753-98-6
  • KEGG: C09684
  • LipidMAPS: LMPR0103110001
  • BioCYC: CPD-8233
Undecanal

Formula: C11H22O
Exact Mass: 170.1671
Source ID: CNP0235249.0
  • CAS Registry: 112-44-7
  • KEGG:
  • LipidMAPS: LMFA06000064
  • BioCYC:
Ethyl acetate

Formula: C4H8O2
Exact Mass: 88.0524
Source ID: CNP0322418.0
  • CAS Registry: 141-78-6
  • KEGG: C00849
  • LipidMAPS:
  • BioCYC: ETHYLACETATE
m-Xylene

Formula: C8H10
Exact Mass: 106.0782
Source ID: CNP0152592.0
  • CAS Registry: 108-38-3
  • KEGG: C07208
  • LipidMAPS:
  • BioCYC: META-XYLENE
Pyridoxine

Formula: C8H11NO3
Exact Mass: 169.0739
Source ID: CNP0297581.0
  • CAS Registry: 65-23-6
  • KEGG: C00314
  • LipidMAPS:
  • BioCYC: PYRIDOXINE
Propanoate

Formula: C3H6O2
Exact Mass: 74.0368
Source ID: CNP0572679.0
  • CAS Registry: 79-09-4
  • KEGG: C00163
  • LipidMAPS: LMFA01010003
  • BioCYC:
9H-purine

Formula: C5H4N4
Exact Mass: 120.0436
Source ID: CNP0533765.0
  • CAS Registry: 120-73-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Oxalate

Formula: C2H2O4
Exact Mass: 89.9953
Source ID: CNP0235859.0
  • CAS Registry: 144-62-7
  • KEGG: C00209
  • LipidMAPS: LMFA01170031
  • BioCYC: OXALATE
Formate

Formula: CH2O2
Exact Mass: 46.0055
Source ID: CNP0494819.0
  • CAS Registry: 64-18-6
  • KEGG: C00058
  • LipidMAPS: LMFA01010040
  • BioCYC: FORMATE
Piperine

Formula: C17H19NO3
Exact Mass: 285.1365
Source ID: CNP0193594.0
  • CAS Registry: 94-62-2
  • KEGG: C03882
  • LipidMAPS:
  • BioCYC: N-EE-PIPEROYL-PIPERIDINE
8-Anilino-1-naphthalene sulfonic acid

Formula: C16H13NO3S
Exact Mass: 299.0616
Source ID: CNP0079789.0
  • CAS Registry: 82-76-8
  • KEGG: C11326
  • LipidMAPS:
  • BioCYC:
Pyruvate

Formula: C3H4O3
Exact Mass: 88.016
Source ID: CNP0269827.0
  • CAS Registry: 127-17-3
  • KEGG: C00022
  • LipidMAPS: LMFA01060077
  • BioCYC: PYRUVATE
Dopamine

Formula: C8H11NO2
Exact Mass: 153.079
Source ID: CNP0254743.0
  • CAS Registry: 51-61-6
  • KEGG: C03758
  • LipidMAPS:
  • BioCYC: DOPAMINE
Tyramine

Formula: C8H11NO
Exact Mass: 137.0841
Source ID: CNP0111205.0
  • CAS Registry: 51-67-2
  • KEGG: C00483
  • LipidMAPS:
  • BioCYC: TYRAMINE
3-Cresol

Formula: C7H8O
Exact Mass: 108.0575
Source ID: CNP0355586.0
  • CAS Registry: 108-39-4
  • KEGG: C01467
  • LipidMAPS:
  • BioCYC: CPD-112
Icosanoic acid

Formula: C20H40O2
Exact Mass: 312.3028
Source ID: CNP0374238.0
  • CAS Registry: 506-30-9
  • KEGG: C06425
  • LipidMAPS: LMFA01010020
  • BioCYC: ARACHIDIC_ACID
N-Methylnicotinate

Formula: C7H7NO2
Exact Mass: 137.0477
Source ID: CNP0337775.0
  • CAS Registry: 535-83-1
  • KEGG: C01004
  • LipidMAPS:
  • BioCYC: METHYLNICOTINATE
Isoleucyl-Isoleucine

Formula: C12H24N2O3
Exact Mass: 244.1787
Source ID: CNP0180478.1
  • CAS Registry: 42537-99-5
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-20357
Isoeugenol

Formula: C10H12O2
Exact Mass: 164.0837
Source ID: CNP0315621.0
  • CAS Registry: 97-54-1
  • KEGG: C10469
  • LipidMAPS:
  • BioCYC: ISOEUGENOL
Tetradecanoic acid

Formula: C14H28O2
Exact Mass: 228.2089
Source ID: CNP0262703.0
  • CAS Registry: 544-63-8
  • KEGG: C06424
  • LipidMAPS: LMFA01010014
  • BioCYC: CPD-7836
L-Citrulline

Formula: C6H13N3O3
Exact Mass: 175.0957
Source ID: CNP0209633.1
  • CAS Registry: 372-75-8
  • KEGG: C00327
  • LipidMAPS:
  • BioCYC: L-CITRULLINE
Alanine

Formula: C3H7NO2
Exact Mass: 89.0477
Source ID: CNP0313085.1
  • CAS Registry: 302-72-7
  • KEGG: C01401
  • LipidMAPS:
  • BioCYC: L-ALPHA-ALANINE
Galacturonic acid

Formula: C6H10O7
Exact Mass: 194.0427
Source ID: CNP0253201.1
  • CAS Registry: 14982-50-4
  • KEGG: C08348
  • LipidMAPS:
  • BioCYC:
Pentanoate

Formula: C5H10O2
Exact Mass: 102.0681
Source ID: CNP0144818.0
  • CAS Registry: 109-52-4
  • KEGG: C00803
  • LipidMAPS: LMFA01010005
  • BioCYC:
2-Pentylfuran

Formula: C9H14O
Exact Mass: 138.1045
Source ID: CNP0210535.0
  • CAS Registry: 3777-69-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,6-Dimethylpyrazine

Formula: C6H8N2
Exact Mass: 108.0687
Source ID: CNP0296461.0
  • CAS Registry: 108-50-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Octanol

Formula: C8H18O
Exact Mass: 130.1358
Source ID: CNP0368614.0
  • CAS Registry: 111-87-5
  • KEGG: C00756
  • LipidMAPS: LMFA05000130
  • BioCYC: OCTANOL
Propane-1-ol

Formula: C3H8O
Exact Mass: 60.0575
Source ID: CNP0605151.0
  • CAS Registry: 71-23-8
  • KEGG: C05979
  • LipidMAPS: LMFA05000101
  • BioCYC: PROPANOL
Pentane

Formula: C5H12
Exact Mass: 72.0939
Source ID: CNP0486380.0
  • CAS Registry: 109-66-0
  • KEGG:
  • LipidMAPS: LMFA11000583
  • BioCYC: CPD-9285
p-Cymene

Formula: C10H14
Exact Mass: 134.1095
Source ID: CNP0145577.0
  • CAS Registry: 99-87-6
  • KEGG: C06575
  • LipidMAPS: LMPR0102090014
  • BioCYC: CPD-1001
Naringenin

Formula: C15H12O5
Exact Mass: 272.0685
Source ID: CNP0218028.1
  • CAS Registry: 480-41-1
  • KEGG: C00509
  • LipidMAPS: LMPK12140001
  • BioCYC: NARINGENIN-CMPD
Phenol

Formula: C6H6O
Exact Mass: 94.0419
Source ID: CNP0155356.0
  • CAS Registry: 108-95-2
  • KEGG: C00146
  • LipidMAPS:
  • BioCYC: PHENOL
Heneicosane

Formula: C21H44
Exact Mass: 296.3443
Source ID: CNP0342329.0
  • CAS Registry: 629-94-7
  • KEGG:
  • LipidMAPS: LMFA11000572
  • BioCYC:
Aniline

Formula: C6H7N
Exact Mass: 93.0578
Source ID: CNP0102805.0
  • CAS Registry: 62-53-3
  • KEGG: C00292
  • LipidMAPS:
  • BioCYC: ANILINE
N6-(L-1,3-Dicarboxypropyl)-L-lysine

Formula: C11H20N2O6
Exact Mass: 276.1321
Source ID: CNP0110239.1
  • CAS Registry: 997-68-2
  • KEGG: C00449
  • LipidMAPS:
  • BioCYC: SACCHAROPINE
Heptanoic acid

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0141686.0
  • CAS Registry: 111-14-8
  • KEGG: C17714
  • LipidMAPS: LMFA01010007
  • BioCYC: CPD-7619
myo-Inositol

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0254016.2
  • CAS Registry: 87-89-8
  • KEGG: C00137
  • LipidMAPS:
  • BioCYC: MYO-INOSITOL
Octadecane

Formula: C18H38
Exact Mass: 254.2973
Source ID: CNP0316858.0
  • CAS Registry: 593-45-3
  • KEGG:
  • LipidMAPS: LMFA11000581
  • BioCYC: CPD-16902
Serotonin

Formula: C10H12N2O
Exact Mass: 176.095
Source ID: CNP0110235.0
  • CAS Registry: 50-67-9
  • KEGG: C00780
  • LipidMAPS:
  • BioCYC: SEROTONIN
4-Isopropylbenzaldehyde

Formula: C10H12O
Exact Mass: 148.0888
Source ID: CNP0195353.0
  • CAS Registry: 122-03-2
  • KEGG: C06577
  • LipidMAPS:
  • BioCYC: CPD-1003
Malonate

Formula: C3H4O4
Exact Mass: 104.011
Source ID: CNP0327247.0
  • CAS Registry: 141-82-2
  • KEGG: C00383
  • LipidMAPS: LMFA01170041
  • BioCYC: MALONATE
m-Aminobenzoic acid

Formula: C7H7NO2
Exact Mass: 137.0477
Source ID: CNP0081123.0
  • CAS Registry: 99-05-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Phenethylamine

Formula: C8H11N
Exact Mass: 121.0891
Source ID: CNP0141127.0
  • CAS Registry: 64-04-0
  • KEGG: C05332
  • LipidMAPS:
  • BioCYC:
Phenylacetic acid

Formula: C8H8O2
Exact Mass: 136.0524
Source ID: CNP0311203.0
  • CAS Registry: 103-82-2
  • KEGG: C07086
  • LipidMAPS:
  • BioCYC: PHENYLACETATE
Glutamate

Formula: C5H9NO4
Exact Mass: 147.0532
Source ID: CNP0191057.1
  • CAS Registry: 617-65-2
  • KEGG: C00302
  • LipidMAPS:
  • BioCYC:
p-Benzoquinone

Formula: C6H4O2
Exact Mass: 108.0211
Source ID: CNP0164682.0
  • CAS Registry: 106-51-4
  • KEGG: C00472
  • LipidMAPS:
  • BioCYC: P-BENZOQUINONE
Citrate

Formula: C6H8O7
Exact Mass: 192.027
Source ID: CNP0149674.0
  • CAS Registry: 77-92-9
  • KEGG: C00158
  • LipidMAPS:
  • BioCYC: CIT
Indole-3-acetate

Formula: C10H9NO2
Exact Mass: 175.0633
Source ID: CNP0284198.0
  • CAS Registry: 87-51-4
  • KEGG: C00954
  • LipidMAPS:
  • BioCYC:
Hexacosane

Formula: C26H54
Exact Mass: 366.4225
Source ID: CNP0227499.0
  • CAS Registry: 630-01-3
  • KEGG:
  • LipidMAPS: LMFA11000576
  • BioCYC: CPD-9763
Methylamine

Formula: CH5N
Exact Mass: 31.0422
Source ID: CNP0593707.0
  • CAS Registry: 74-89-5
  • KEGG: C00218
  • LipidMAPS:
  • BioCYC: METHYLAMINE
gamma-Glutamylphenylalanine

Formula: C14H18N2O5
Exact Mass: 294.1216
Source ID: CNP0175820.1
  • CAS Registry: 7432-24-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Diallyl sulfide

Formula: C6H10S
Exact Mass: 114.0503
Source ID: CNP0303954.0
  • CAS Registry: 592-88-1
  • KEGG: C08370
  • LipidMAPS:
  • BioCYC:
Tricosane

Formula: C23H48
Exact Mass: 324.3756
Source ID: CNP0367486.0
  • CAS Registry: 638-67-5
  • KEGG: C17433
  • LipidMAPS: LMFA11000589
  • BioCYC: CPD-7947
1-Isopropyl-2-methylbenzene

Formula: C10H14
Exact Mass: 134.1095
Source ID: CNP0093801.0
  • CAS Registry: 527-84-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Quinate

Formula: C7H12O6
Exact Mass: 192.0634
Source ID: CNP0205647.1
  • CAS Registry: 77-95-2
  • KEGG: C00296
  • LipidMAPS:
  • BioCYC: QUINATE
Glutarate

Formula: C5H8O4
Exact Mass: 132.0423
Source ID: CNP0256820.0
  • CAS Registry: 110-94-1
  • KEGG: C00489
  • LipidMAPS: LMFA01170046
  • BioCYC:
3,4-Dihydroxyphenylacetate

Formula: C8H8O4
Exact Mass: 168.0423
Source ID: CNP0276169.0
  • CAS Registry: 102-32-9
  • KEGG: C01161
  • LipidMAPS:
  • BioCYC:
Butanal

Formula: C4H8O
Exact Mass: 72.0575
Source ID: CNP0518034.0
  • CAS Registry: 123-72-8
  • KEGG: C01412
  • LipidMAPS:
  • BioCYC: BUTANAL
Shikimate

Formula: C7H10O5
Exact Mass: 174.0528
Source ID: CNP0162867.1
  • CAS Registry: 138-59-0
  • KEGG: C00493
  • LipidMAPS:
  • BioCYC:
L-Valine

Formula: C5H11NO2
Exact Mass: 117.079
Source ID: CNP0152507.1
  • CAS Registry: 72-18-4
  • KEGG: C00183
  • LipidMAPS:
  • BioCYC: VAL
beta-D-Galactose

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0210547.7
  • CAS Registry: 7296-64-2
  • KEGG: C00962
  • LipidMAPS:
  • BioCYC: GALACTOSE
Glycolate

Formula: C2H4O3
Exact Mass: 76.016
Source ID: CNP0564020.0
  • CAS Registry: 79-14-1
  • KEGG: C00160
  • LipidMAPS: LMFA01050148
  • BioCYC: GLYCOLLATE
Asparagine

Formula: C4H8N2O3
Exact Mass: 132.0535
Source ID: CNP0267849.1
  • CAS Registry: 3130-87-8
  • KEGG: C16438
  • LipidMAPS:
  • BioCYC:
L-Proline

Formula: C5H9NO2
Exact Mass: 115.0633
Source ID: CNP0219104.1
  • CAS Registry: 147-85-3
  • KEGG: C00148
  • LipidMAPS:
  • BioCYC: PRO
2-Nonanone

Formula: C9H18O
Exact Mass: 142.1358
Source ID: CNP0364677.0
  • CAS Registry: 821-55-6
  • KEGG:
  • LipidMAPS: LMFA12000052
  • BioCYC: CPD-18989
Tridecanal

Formula: C13H26O
Exact Mass: 198.1984
Source ID: CNP0222214.0
  • CAS Registry: 10486-19-8
  • KEGG:
  • LipidMAPS: LMFA06000074
  • BioCYC:
Methylglyoxal

Formula: C3H4O2
Exact Mass: 72.0211
Source ID: CNP0574322.0
  • CAS Registry: 78-98-8
  • KEGG: C00546
  • LipidMAPS:
  • BioCYC: METHYL-GLYOXAL
Spermidine

Formula: C7H19N3
Exact Mass: 145.1579
Source ID: CNP0279184.0
  • CAS Registry: 124-20-9
  • KEGG: C00315
  • LipidMAPS:
  • BioCYC: SPERMIDINE
Decanoic acid

Formula: C10H20O2
Exact Mass: 172.1463
Source ID: CNP0213238.0
  • CAS Registry: 334-48-5
  • KEGG: C01571
  • LipidMAPS: LMFA01010010
  • BioCYC: CPD-3617
(+)-(S)-Carvone

Formula: C10H14O
Exact Mass: 150.1045
Source ID: CNP0244112.1
  • CAS Registry: 2244-16-8
  • KEGG: C11383
  • LipidMAPS:
  • BioCYC: CPD-10037
(-)-alpha-Cedrene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0259981.1
  • CAS Registry: 469-61-4
  • KEGG: C22909
  • LipidMAPS:
  • BioCYC:
Theobromine

Formula: C7H8N4O2
Exact Mass: 180.0647
Source ID: CNP0568853.0
  • CAS Registry: 83-67-0
  • KEGG: C07480
  • LipidMAPS:
  • BioCYC: 3-7-DIMETHYLXANTHINE
Butylamine

Formula: C4H11N
Exact Mass: 73.0891
Source ID: CNP0597509.0
  • CAS Registry: 13952-84-6
  • KEGG: C18706
  • LipidMAPS:
  • BioCYC: CPD-3627
Lactose

Formula: C12H22O11
Exact Mass: 342.1162
Source ID: CNP0226604.4
  • CAS Registry: 63-42-3
  • KEGG: C00243
  • LipidMAPS:
  • BioCYC: CPD-15972
Octanoic acid

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0295653.0
  • CAS Registry: 124-07-2
  • KEGG: C06423
  • LipidMAPS: LMFA01010008
  • BioCYC: CPD-195
(-)-alpha-Pinene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0203449.1
  • CAS Registry: 7785-26-4
  • KEGG: C06308
  • LipidMAPS:
  • BioCYC: CPD-4892
Nordazepam

Formula: C15H11ClN2O
Exact Mass: 270.056
Source ID: CNP0312277.0
  • CAS Registry: 1088-11-5
  • KEGG: C07486
  • LipidMAPS:
  • BioCYC:
Isoleucine

Formula: C6H13NO2
Exact Mass: 131.0946
Source ID: CNP0337843.1
  • CAS Registry: 443-79-8
  • KEGG: C16434
  • LipidMAPS:
  • BioCYC:
Acetaldehyde

Formula: C2H4O
Exact Mass: 44.0262
Source ID: CNP0566693.0
  • CAS Registry: 75-07-0
  • KEGG: C00084
  • LipidMAPS:
  • BioCYC: ACETALD
threonic acid

Formula: C4H8O5
Exact Mass: 136.0372
Source ID: CNP0144827.1
  • CAS Registry: 3909-12-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Diaminobutyric acid

Formula: C4H10N2O2
Exact Mass: 118.0742
Source ID: CNP0283118.1
  • CAS Registry: 765240-63-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
alpha-Carotene

Formula: C40H56
Exact Mass: 536.4382
Source ID: CNP0220836.1
  • CAS Registry: 7488-99-5
  • KEGG: C05433
  • LipidMAPS: LMPR01070258
  • BioCYC: CPD1F-118
Aromatic primary alcohol

Formula: C7H8O
Exact Mass: 108.0575
Source ID: CNP0263608.0
  • CAS Registry: 100-51-6
  • KEGG: C03485
  • LipidMAPS:
  • BioCYC: BENZYL-ALCOHOL
Tetracosanoic acid

Formula: C24H48O2
Exact Mass: 368.3654
Source ID: CNP0175519.0
  • CAS Registry: 557-59-5
  • KEGG: C08320
  • LipidMAPS: LMFA01010024
  • BioCYC: TETRACOSANOATE
2-Undecanone

Formula: C11H22O
Exact Mass: 170.1671
Source ID: CNP0310446.0
  • CAS Registry: 112-12-9
  • KEGG: C01875
  • LipidMAPS: LMFA12000002
  • BioCYC: 2-UNDECANONE
Lignocerane

Formula: C24H50
Exact Mass: 338.3912
Source ID: CNP0366009.0
  • CAS Registry: 646-31-1
  • KEGG:
  • LipidMAPS: LMFA11000585
  • BioCYC:
4-hydroxy-7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridin-2-one

Formula: C17H20N4O6
Exact Mass: 376.1383
Source ID: CNP0561800.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Sebacic acid

Formula: C10H18O4
Exact Mass: 202.1205
Source ID: CNP0311812.0
  • CAS Registry: 111-20-6
  • KEGG: C08277
  • LipidMAPS: LMFA01170006
  • BioCYC: CPD-3623
Docosanoic acid

Formula: C22H44O2
Exact Mass: 340.3341
Source ID: CNP0215073.0
  • CAS Registry: 112-85-6
  • KEGG: C08281
  • LipidMAPS: LMFA01010022
  • BioCYC:


Formula: C27H36O5
Exact Mass: 440.2563
Source ID: CNP0093461.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Aromatic acid

Formula: C7H6O2
Exact Mass: 122.0368
Source ID: CNP0136227.0
  • CAS Registry: 65-85-0
  • KEGG: C00539
  • LipidMAPS:
  • BioCYC: BENZOATE
Acetone

Formula: C3H6O
Exact Mass: 58.0419
Source ID: CNP0572494.0
  • CAS Registry: 67-64-1
  • KEGG: C00207
  • LipidMAPS: LMFA12000057
  • BioCYC: ACETONE
Furfural

Formula: C5H4O2
Exact Mass: 96.0211
Source ID: CNP0178160.0
  • CAS Registry: 98-01-1
  • KEGG: C14279
  • LipidMAPS:
  • BioCYC: CPD0-2357
Propanal

Formula: C3H6O
Exact Mass: 58.0419
Source ID: CNP0570013.0
  • CAS Registry: 123-38-6
  • KEGG: C00479
  • LipidMAPS:
  • BioCYC: CPD-665
Succinate

Formula: C4H6O4
Exact Mass: 118.0266
Source ID: CNP0332012.0
  • CAS Registry: 110-15-6
  • KEGG: C00042
  • LipidMAPS: LMFA01170043
  • BioCYC: SUC
Eugenol

Formula: C10H12O2
Exact Mass: 164.0837
Source ID: CNP0134292.0
  • CAS Registry: 97-53-0
  • KEGG: C10453
  • LipidMAPS:
  • BioCYC: CPD-6481
Glutathione

Formula: C10H17N3O6S
Exact Mass: 307.0838
Source ID: CNP0104130.1
  • CAS Registry: 70-18-8
  • KEGG: C00051
  • LipidMAPS:
  • BioCYC: GLUTATHIONE
Guaiacol

Formula: C7H8O2
Exact Mass: 124.0524
Source ID: CNP0269885.0
  • CAS Registry: 90-05-1
  • KEGG: C15572
  • LipidMAPS:
  • BioCYC: CPD-400
Skatole

Formula: C9H9N
Exact Mass: 131.0735
Source ID: CNP0217136.0
  • CAS Registry: 83-34-1
  • KEGG: C08313
  • LipidMAPS:
  • BioCYC: SKATOLE
Acetylcholine

Formula: C7H16NO2
Exact Mass: 146.1181
Source ID: CNP0584438.0
  • CAS Registry: 51-84-3
  • KEGG: C01996
  • LipidMAPS:
  • BioCYC: ACETYLCHOLINE
beta-Cubebene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0198091.1
  • CAS Registry: 13744-15-5
  • KEGG: C09648
  • LipidMAPS: LMPR0103440002
  • BioCYC: CPD-8803
3-Heptanone

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0286726.0
  • CAS Registry: 106-35-4
  • KEGG:
  • LipidMAPS: LMFA12000047
  • BioCYC:
Glycerol

Formula: C3H8O3
Exact Mass: 92.0473
Source ID: CNP0259986.0
  • CAS Registry: 56-81-5
  • KEGG: C00116
  • LipidMAPS:
  • BioCYC: GLYCEROL
Diphenylamine

Formula: C12H11N
Exact Mass: 169.0891
Source ID: CNP0314112.0
  • CAS Registry: 122-39-4
  • KEGG: C11016
  • LipidMAPS:
  • BioCYC: CPD-9937
Guaiazulene

Formula: C15H18
Exact Mass: 198.1408
Source ID: CNP0186815.0
  • CAS Registry: 489-84-9
  • KEGG: C09675
  • LipidMAPS: LMPR0103410006
  • BioCYC:
2-Pentadecanone

Formula: C15H30O
Exact Mass: 226.2297
Source ID: CNP0264327.0
  • CAS Registry: 2345-28-0
  • KEGG:
  • LipidMAPS: LMFA12000056
  • BioCYC: CPD-7898
Phylloquinone

Formula: C31H46O2
Exact Mass: 450.3498
Source ID: CNP0273613.1
  • CAS Registry: 84-80-0
  • KEGG: C02059
  • LipidMAPS: LMPR02030028
  • BioCYC: 2-METHYL-3-PHYTYL-14-NAPHTHOQUINONE
L-Threonine

Formula: C4H9NO3
Exact Mass: 119.0582
Source ID: CNP0361197.1
  • CAS Registry: 72-19-5
  • KEGG: C00188
  • LipidMAPS:
  • BioCYC: THR
Terpinolene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0160264.0
  • CAS Registry: 586-62-9
  • KEGG: C06075
  • LipidMAPS: LMPR0102090062
  • BioCYC: CPD-4890
(-)-Linalool

Formula: C10H18O
Exact Mass: 154.1358
Source ID: CNP0373115.1
  • CAS Registry: 126-91-0
  • KEGG: C11388
  • LipidMAPS: LMPR0102010013
  • BioCYC: CPD-8996
Methanol

Formula: CH4O
Exact Mass: 32.0262
Source ID: CNP0534529.0
  • CAS Registry: 67-56-1
  • KEGG: C00132
  • LipidMAPS:
  • BioCYC: METOH
Ethanolamine

Formula: C2H7NO
Exact Mass: 61.0528
Source ID: CNP0581653.0
  • CAS Registry: 141-43-5
  • KEGG: C00189
  • LipidMAPS:
  • BioCYC:
2,5-Dihydroxybenzoic acid

Formula: C7H6O4
Exact Mass: 154.0266
Source ID: CNP0187458.0
  • CAS Registry: 490-79-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
L-Lysine

Formula: C6H14N2O2
Exact Mass: 146.1055
Source ID: CNP0204700.1
  • CAS Registry: 56-87-1
  • KEGG: C00047
  • LipidMAPS:
  • BioCYC: LYS
Dodecylaldehyde

Formula: C12H24O
Exact Mass: 184.1827
Source ID: CNP0211650.0
  • CAS Registry: 112-54-9
  • KEGG: C02278
  • LipidMAPS: LMFA06000071
  • BioCYC: CPD-7880
Nicotinate

Formula: C6H5NO2
Exact Mass: 123.032
Source ID: CNP0319168.0
  • CAS Registry: 59-67-6
  • KEGG: C00253
  • LipidMAPS:
  • BioCYC: NIACINE
Lutein

Formula: C40H56O2
Exact Mass: 568.428
Source ID: CNP0216202.1
  • CAS Registry: 127-40-2
  • KEGG: C08601
  • LipidMAPS: LMPR01070274
  • BioCYC: CPD1F-119
Glycine

Formula: C2H5NO2
Exact Mass: 75.032
Source ID: CNP0563879.0
  • CAS Registry: 56-40-6
  • KEGG: C00037
  • LipidMAPS:
  • BioCYC: GLY
Butanoic acid

Formula: C4H8O2
Exact Mass: 88.0524
Source ID: CNP0259447.0
  • CAS Registry: 107-92-6
  • KEGG: C00246
  • LipidMAPS: LMFA01010004
  • BioCYC: BUTYRIC_ACID
D-Xylose

Formula: C5H10O5
Exact Mass: 150.0528
Source ID: CNP0260454.3
  • CAS Registry: 58-86-6
  • KEGG: C00181
  • LipidMAPS:
  • BioCYC: D-Xylose
n-Hexane

Formula: C6H14
Exact Mass: 86.1095
Source ID: CNP0269021.0
  • CAS Registry: 110-54-3
  • KEGG: C11271
  • LipidMAPS: LMFA11000007
  • BioCYC: CPD-9288
N-Methyltyramine

Formula: C9H13NO
Exact Mass: 151.0997
Source ID: CNP0279481.0
  • CAS Registry: 370-98-9
  • KEGG: C02442
  • LipidMAPS:
  • BioCYC:
(S)-Propane-1,2-diol

Formula: C3H8O2
Exact Mass: 76.0524
Source ID: CNP0522839.1
  • CAS Registry: 4254-15-3
  • KEGG: C02917
  • LipidMAPS:
  • BioCYC: PROPANE-1-2-DIOL
Pentan-2-one

Formula: C5H10O
Exact Mass: 86.0732
Source ID: CNP0169448.0
  • CAS Registry: 107-87-9
  • KEGG: C01949
  • LipidMAPS: LMFA12000003
  • BioCYC: PENTAN-2-ONE
Ethylamine

Formula: C2H7N
Exact Mass: 45.0578
Source ID: CNP0561286.0
  • CAS Registry: 75-04-7
  • KEGG: C00797
  • LipidMAPS:
  • BioCYC: ETHANAMINE
N-Acetyl-beta-D-glucosamine

Formula: C8H15NO6
Exact Mass: 221.0899
Source ID: CNP0246160.1
  • CAS Registry: 14131-68-1
  • KEGG: C03878
  • LipidMAPS:
  • BioCYC:
Melatonin

Formula: C13H16N2O2
Exact Mass: 232.1212
Source ID: CNP0139257.0
  • CAS Registry: 73-31-4
  • KEGG: C01598
  • LipidMAPS:
  • BioCYC: N-ACETYL-5-METHOXY-TRYPTAMINE
3',5'-Cyclic AMP

Formula: C10H12N5O6P
Exact Mass: 329.0525
Source ID: CNP0325085.1
  • CAS Registry: 60-92-4
  • KEGG: C00575
  • LipidMAPS:
  • BioCYC: CAMP
Prostaglandin B2

Formula: C20H30O4
Exact Mass: 334.2144
Source ID: CNP0346263.1
  • CAS Registry: 13367-85-6
  • KEGG: C05954
  • LipidMAPS: LMFA03010018
  • BioCYC:
Ethylbenzene

Formula: C8H10
Exact Mass: 106.0782
Source ID: CNP0245508.0
  • CAS Registry: 100-41-4
  • KEGG: C07111
  • LipidMAPS:
  • BioCYC: ETHYLBENZENE
4-Cresol

Formula: C7H8O
Exact Mass: 108.0575
Source ID: CNP0267550.0
  • CAS Registry: 106-44-5
  • KEGG: C01468
  • LipidMAPS:
  • BioCYC: CPD-108
Octane

Formula: C8H18
Exact Mass: 114.1408
Source ID: CNP0286567.0
  • CAS Registry: 111-65-9
  • KEGG: C01387
  • LipidMAPS: LMFA11000002
  • BioCYC: CPD-148
Benzylamine

Formula: C7H9N
Exact Mass: 107.0735
Source ID: CNP0287581.0
  • CAS Registry: 100-46-9
  • KEGG: C15562
  • LipidMAPS:
  • BioCYC: BENZYLAMINE
Estragole

Formula: C10H12O
Exact Mass: 148.0888
Source ID: CNP0191217.0
  • CAS Registry: 140-67-0
  • KEGG: C10452
  • LipidMAPS:
  • BioCYC: CPD-6484
Dimethyl sulfide

Formula: C2H6S
Exact Mass: 62.019
Source ID: CNP0569922.0
  • CAS Registry: 75-18-3
  • KEGG: C00580
  • LipidMAPS:
  • BioCYC: CPD-7670
Methyl allyl disulfide

Formula: C4H8S2
Exact Mass: 120.0067
Source ID: CNP0333880.0
  • CAS Registry: 2179-58-0
  • KEGG: C08383
  • LipidMAPS:
  • BioCYC:
Dodecanoic acid

Formula: C12H24O2
Exact Mass: 200.1776
Source ID: CNP0303017.0
  • CAS Registry: 143-07-7
  • KEGG: C02679
  • LipidMAPS: LMFA01010012
  • BioCYC: DODECANOATE
(+)-Norephedrine

Formula: C9H13NO
Exact Mass: 151.0997
Source ID: CNP0148528.2
  • CAS Registry: 37577-28-9
  • KEGG: C02343
  • LipidMAPS:
  • BioCYC: CPD-23455
Butylhydroxytoluene

Formula: C15H24O
Exact Mass: 220.1827
Source ID: CNP0327997.0
  • CAS Registry: 128-37-0
  • KEGG: C14693
  • LipidMAPS:
  • BioCYC:
(+)-Borneol

Formula: C10H18O
Exact Mass: 154.1358
Source ID: CNP0259481.3
  • CAS Registry: 464-43-7
  • KEGG: C01765
  • LipidMAPS: LMPR0102120003
  • BioCYC: CPD-1903
1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphate

Formula: C37H71O8P
Exact Mass: 674.4886
Source ID: CNP0132464.1
  • CAS Registry: 62600-81-1
  • KEGG: C13889
  • LipidMAPS: LMGP10010032
  • BioCYC:
Syringic acid

Formula: C9H10O5
Exact Mass: 198.0528
Source ID: CNP0155116.0
  • CAS Registry: 530-57-4
  • KEGG: C10833
  • LipidMAPS:
  • BioCYC:
Diazepam

Formula: C16H13ClN2O
Exact Mass: 284.0716
Source ID: CNP0315180.0
  • CAS Registry: 439-14-5
  • KEGG: C06948
  • LipidMAPS:
  • BioCYC:
Phytic acid

Formula: C6H18O24P6
Exact Mass: 659.8614
Source ID: CNP0234211.1
  • CAS Registry: 83-86-3
  • KEGG: C01204
  • LipidMAPS:
  • BioCYC: HEXAKISPHOSPHATE
Raffinose

Formula: C18H32O16
Exact Mass: 504.169
Source ID: CNP0246211.1
  • CAS Registry: 512-69-6
  • KEGG: C00492
  • LipidMAPS:
  • BioCYC: CPD-1099
Prostaglandin F1alpha

Formula: C20H36O5
Exact Mass: 356.2563
Source ID: CNP0266801.1
  • CAS Registry: 745-62-0
  • KEGG: C06475
  • LipidMAPS: LMFA03010137
  • BioCYC:
Carvacrol

Formula: C10H14O
Exact Mass: 150.1045
Source ID: CNP0210919.0
  • CAS Registry: 499-75-2
  • KEGG: C09840
  • LipidMAPS: LMPR0102090017
  • BioCYC: CPD-23478
Nicotinamide

Formula: C6H6N2O
Exact Mass: 122.048
Source ID: CNP0150794.0
  • CAS Registry: 98-92-0
  • KEGG: C00153
  • LipidMAPS:
  • BioCYC: NIACINAMIDE
Megastigmatrienone

Formula: C13H18O
Exact Mass: 190.1358
Source ID: CNP0182854.0
  • CAS Registry: 5896-02-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Oxidized Latia luciferin

Formula: C13H22O
Exact Mass: 194.1671
Source ID: CNP0289751.0
  • CAS Registry: 17283-81-7
  • KEGG: C03527
  • LipidMAPS:
  • BioCYC: OXIDIZED-LATIA-LUCIFERIN
beta-Cyclocitral

Formula: C10H16O
Exact Mass: 152.1201
Source ID: CNP0108027.0
  • CAS Registry: 432-25-7
  • KEGG: C20425
  • LipidMAPS:
  • BioCYC: CPD-21186
Canthaxanthin

Formula: C40H52O2
Exact Mass: 564.3967
Source ID: CNP0355008.0
  • CAS Registry: 514-78-3
  • KEGG: C08583
  • LipidMAPS: LMPR01070264
  • BioCYC: CPD-7851
Astaxanthin

Formula: C40H52O4
Exact Mass: 596.3865
Source ID: CNP0190579.1
  • CAS Registry: 472-61-7
  • KEGG: C08580
  • LipidMAPS: LMPR01070800
  • BioCYC: CPD-11473
3,7,11,15-Tetramethyl-2,4,6,8,10,14-hexadecahexaenoic acid

Formula: C20H28O2
Exact Mass: 300.2089
Source ID: CNP0344097.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
9-cis-Retinal

Formula: C20H28O
Exact Mass: 284.214
Source ID: CNP0273964.0
  • CAS Registry: 514-85-2
  • KEGG: C16681
  • LipidMAPS: LMPR01090017
  • BioCYC: CPD-13536
9-cis-Retinal

Formula: C20H28O
Exact Mass: 284.214
Source ID: CNP0181557.0
  • CAS Registry: 514-85-2
  • KEGG: C16681
  • LipidMAPS: LMPR01090017
  • BioCYC: CPD-13536
all-trans-4-Oxoretinoic acid

Formula: C20H26O3
Exact Mass: 314.1882
Source ID: CNP0151069.0
  • CAS Registry: 38030-57-8
  • KEGG: C16678
  • LipidMAPS: LMPR01090026
  • BioCYC:
Lutein

Formula: C40H56O2
Exact Mass: 568.428
Source ID: CNP0216202.5
  • CAS Registry: 127-40-2
  • KEGG: C08601
  • LipidMAPS: LMPR01070274
  • BioCYC: CPD1F-119
3'-Dehydrolutein

Formula: C40H54O2
Exact Mass: 566.4124
Source ID: CNP0260326.1
  • CAS Registry: 97134-08-2
  • KEGG:
  • LipidMAPS: LMPR01070198
  • BioCYC:
epsilon,epsilon-Carotene-3,3'-dione

Formula: C40H52O2
Exact Mass: 564.3967
Source ID: CNP0344063.3
  • CAS Registry: 97169-05-6
  • KEGG:
  • LipidMAPS: LMPR01070197
  • BioCYC:


Formula: C40H54O2
Exact Mass: 566.4124
Source ID: CNP0344065.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(all-E)-6'-Apo-y-caroten-6'-al

Formula: C32H42O
Exact Mass: 442.3235
Source ID: CNP0124992.0
  • CAS Registry: 22255-36-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Apo-8'-lycopenal

Formula: C30H40O
Exact Mass: 416.3079
Source ID: CNP0186335.0
  • CAS Registry: 2213-22-1
  • KEGG:
  • LipidMAPS: LMPR01071061
  • BioCYC: CPD-21147
Apo-10'-lycopenal

Formula: C27H36O
Exact Mass: 376.2766
Source ID: CNP0359630.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMPR01071063
  • BioCYC: CPD-21148
Apo-12'-lycopenal

Formula: C25H34O
Exact Mass: 350.261
Source ID: CNP0161541.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMPR01071064
  • BioCYC: CPD-21149
Apo-14'-lycopenal

Formula: C22H30O
Exact Mass: 310.2297
Source ID: CNP0220096.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMPR01071065
  • BioCYC: CPD-21205
meso-Zeaxanthin

Formula: C40H56O2
Exact Mass: 568.428
Source ID: CNP0283320.2
  • CAS Registry: 31272-50-1
  • KEGG: C21836
  • LipidMAPS: LMPR01070013
  • BioCYC: CPD-20825


Formula: C41H58O2
Exact Mass: 582.4437
Source ID: CNP0418441.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Benzene

Formula: C6H6
Exact Mass: 78.0469
Source ID: CNP0140642.0
  • CAS Registry: 71-43-2
  • KEGG: C01407
  • LipidMAPS:
  • BioCYC: BENZENE
Isoferulic acid

Formula: C10H10O4
Exact Mass: 194.0579
Source ID: CNP0283368.0
  • CAS Registry: 537-73-5
  • KEGG: C10470
  • LipidMAPS:
  • BioCYC:
Oleanolic acid

Formula: C30H48O3
Exact Mass: 456.3603
Source ID: CNP0213216.3
  • CAS Registry: 508-02-1
  • KEGG: C17148
  • LipidMAPS: LMPR0106150004
  • BioCYC:
Erythritol

Formula: C4H10O4
Exact Mass: 122.0579
Source ID: CNP0150660.1
  • CAS Registry: 149-32-6
  • KEGG: C00503
  • LipidMAPS:
  • BioCYC: ERYTHRITOL
Curcumin

Formula: C21H20O6
Exact Mass: 368.126
Source ID: CNP0337918.0
  • CAS Registry: 458-37-7
  • KEGG: C10443
  • LipidMAPS:
  • BioCYC: CPD-6602
Cerotic acid

Formula: C26H52O2
Exact Mass: 396.3967
Source ID: CNP0126420.0
  • CAS Registry: 506-46-7
  • KEGG: C21931
  • LipidMAPS: LMFA01010026
  • BioCYC:
Octadecanol

Formula: C18H38O
Exact Mass: 270.2922
Source ID: CNP0192475.0
  • CAS Registry: 112-92-5
  • KEGG: D01924
  • LipidMAPS: LMFA05000085
  • BioCYC: CPD-7873
Trihydroxybenzene

Formula: C6H6O3
Exact Mass: 126.0317
Source ID: CNP0308187.0
  • CAS Registry: 87-66-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isocaryophyllene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0212910.3
  • CAS Registry: 118-65-0
  • KEGG: C09691
  • LipidMAPS: LMPR0103120002
  • BioCYC:
Hydroxytyrosol

Formula: C8H10O3
Exact Mass: 154.063
Source ID: CNP0275287.0
  • CAS Registry: 10597-60-1
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-15887
Isovanillic acid

Formula: C8H8O4
Exact Mass: 168.0423
Source ID: CNP0220341.0
  • CAS Registry: 645-08-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,3-Dimethoxybenzene

Formula: C8H10O2
Exact Mass: 138.0681
Source ID: CNP0283758.0
  • CAS Registry: 151-10-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-(Methylthio)propanoate

Formula: C4H8O2S
Exact Mass: 120.0245
Source ID: CNP0143779.0
  • CAS Registry: 646-01-5
  • KEGG: C08276
  • LipidMAPS: LMFA01130006
  • BioCYC:
Glycerone phosphate

Formula: C3H7O6P
Exact Mass: 169.998
Source ID: CNP0257378.0
  • CAS Registry: 57-04-5
  • KEGG: C00111
  • LipidMAPS:
  • BioCYC: DIHYDROXY-ACETONE-PHOSPHATE
Homogentisate

Formula: C8H8O4
Exact Mass: 168.0423
Source ID: CNP0114662.0
  • CAS Registry: 451-13-8
  • KEGG: C00544
  • LipidMAPS:
  • BioCYC:
2-Oxoglutarate

Formula: C5H6O5
Exact Mass: 146.0215
Source ID: CNP0115442.0
  • CAS Registry: 328-50-7
  • KEGG: C00026
  • LipidMAPS:
  • BioCYC: 2-KETOGLUTARATE
Benzenediol

Formula: C6H6O2
Exact Mass: 110.0368
Source ID: CNP0143972.0
  • CAS Registry: 12385-08-9
  • KEGG: C01785
  • LipidMAPS:
  • BioCYC:
Maltotriose

Formula: C18H32O16
Exact Mass: 504.169
Source ID: CNP0198218.1
  • CAS Registry: 1109-28-0
  • KEGG: C01835
  • LipidMAPS:
  • BioCYC: MALTOTRIOSE
Phosphoenolpyruvate

Formula: C3H5O6P
Exact Mass: 167.9824
Source ID: CNP0261818.0
  • CAS Registry: 138-08-9
  • KEGG: C00074
  • LipidMAPS:
  • BioCYC:
2-Aminoethylphosphonate

Formula: C2H8NO3P
Exact Mass: 125.0242
Source ID: CNP0284279.0
  • CAS Registry: 2041-14-7
  • KEGG: C03557
  • LipidMAPS:
  • BioCYC: CPD-1106
Hippurate

Formula: C9H9NO3
Exact Mass: 179.0582
Source ID: CNP0201196.0
  • CAS Registry: 495-69-2
  • KEGG: C01586
  • LipidMAPS:
  • BioCYC: CPD-425
Hydroxypyruvate

Formula: C3H4O4
Exact Mass: 104.011
Source ID: CNP0343498.0
  • CAS Registry: 1113-60-6
  • KEGG: C00168
  • LipidMAPS:
  • BioCYC:
3-(4-Hydroxyphenyl)pyruvate

Formula: C9H8O4
Exact Mass: 180.0423
Source ID: CNP0412003.0
  • CAS Registry: 156-39-8
  • KEGG: C01179
  • LipidMAPS:
  • BioCYC: P-HYDROXY-PHENYLPYRUVATE
4-Aminobenzoate

Formula: C7H7NO2
Exact Mass: 137.0477
Source ID: CNP0152805.0
  • CAS Registry: 150-13-0
  • KEGG: C00568
  • LipidMAPS:
  • BioCYC:
Homovanillate

Formula: C9H10O4
Exact Mass: 182.0579
Source ID: CNP0188137.0
  • CAS Registry: 306-08-1
  • KEGG: C05582
  • LipidMAPS:
  • BioCYC: CPD-7651
Benzophenone

Formula: C13H10O
Exact Mass: 182.0732
Source ID: CNP0150241.0
  • CAS Registry: 119-61-9
  • KEGG: C06354
  • LipidMAPS:
  • BioCYC:
Cysteine

Formula: C3H7NO2S
Exact Mass: 121.0197
Source ID: CNP0280490.1
  • CAS Registry: 3374-22-9
  • KEGG: C00736
  • LipidMAPS:
  • BioCYC:
Hydroxyproline

Formula: C5H9NO3
Exact Mass: 131.0582
Source ID: CNP0368925.1
  • CAS Registry: 51-35-4
  • KEGG: C01157
  • LipidMAPS:
  • BioCYC: 4-HYDROXY-L-PROLINE
Glutamine

Formula: C5H10N2O3
Exact Mass: 146.0691
Source ID: CNP0361973.1
  • CAS Registry: 6899-04-3
  • KEGG: C00303
  • LipidMAPS:
  • BioCYC:
Mannitol

Formula: C6H14O6
Exact Mass: 182.079
Source ID: CNP0190948.1
  • CAS Registry: 69-65-8
  • KEGG: C00392
  • LipidMAPS:
  • BioCYC: MANNITOL
But-3-en-2-one

Formula: C4H6O
Exact Mass: 70.0419
Source ID: CNP0571315.0
  • CAS Registry: 78-94-4
  • KEGG: C20701
  • LipidMAPS: LMFA12000018
  • BioCYC: CPD-8847
Pantothenate

Formula: C9H17NO5
Exact Mass: 219.1107
Source ID: CNP0153142.1
  • CAS Registry: 79-83-4
  • KEGG: C00864
  • LipidMAPS: LMFA08020419
  • BioCYC: PANTOTHENATE
3,5-Dihydroxybenzoic acid

Formula: C7H6O4
Exact Mass: 154.0266
Source ID: CNP0151632.0
  • CAS Registry: 99-10-5
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD0-1274
Cyclohexane-1-carboxylate

Formula: C7H12O2
Exact Mass: 128.0837
Source ID: CNP0244214.0
  • CAS Registry: 98-89-5
  • KEGG: C09822
  • LipidMAPS:
  • BioCYC:
3-Hydroxybenzoate

Formula: C7H6O3
Exact Mass: 138.0317
Source ID: CNP0217243.0
  • CAS Registry: 99-06-9
  • KEGG: C00587
  • LipidMAPS:
  • BioCYC:
D-Proline

Formula: C5H9NO2
Exact Mass: 115.0633
Source ID: CNP0219104.2
  • CAS Registry: 344-25-2
  • KEGG: C00763
  • LipidMAPS:
  • BioCYC: D-PROLINE
2-Hydroxyphenylacetate

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0298923.0
  • CAS Registry: 614-75-5
  • KEGG: C05852
  • LipidMAPS:
  • BioCYC:
4-Ethylbenzoic acid

Formula: C9H10O2
Exact Mass: 150.0681
Source ID: CNP0225284.0
  • CAS Registry: 619-64-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
6-Methylsalicylate

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0206449.0
  • CAS Registry: 567-61-3
  • KEGG: C02657
  • LipidMAPS: LMPK13010002
  • BioCYC: CPD-637
Dipropyl disulfide

Formula: C6H14S2
Exact Mass: 150.0537
Source ID: CNP0328321.0
  • CAS Registry: 629-19-6
  • KEGG: C08373
  • LipidMAPS:
  • BioCYC:
4-Ethylphenol

Formula: C8H10O
Exact Mass: 122.0732
Source ID: CNP0299375.0
  • CAS Registry: 123-07-9
  • KEGG: C13637
  • LipidMAPS:
  • BioCYC: CPD-10596
Equol

Formula: C15H14O3
Exact Mass: 242.0943
Source ID: CNP0121737.1
  • CAS Registry: 531-95-3
  • KEGG: C14131
  • LipidMAPS: LMPK12080003
  • BioCYC: CPD-24424
(R)-3-Hydroxybutanoate

Formula: C4H8O3
Exact Mass: 104.0473
Source ID: CNP0161860.1
  • CAS Registry: 625-72-9
  • KEGG: C01089
  • LipidMAPS: LMFA01050005
  • BioCYC: CPD-335
3-Octanone

Formula: C8H16O
Exact Mass: 128.1201
Source ID: CNP0381627.0
  • CAS Registry: 106-68-3
  • KEGG: C17145
  • LipidMAPS: LMFA12000055
  • BioCYC:
Diaminopimelic acid

Formula: C7H14N2O4
Exact Mass: 190.0954
Source ID: CNP0300688.1
  • CAS Registry: 583-93-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Vanillic acid 4-O-sulfate

Formula: C8H8O7S
Exact Mass: 247.9991
Source ID: CNP0084712.0
  • CAS Registry: 71235-86-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
D-Pipecolic acid

Formula: C6H11NO2
Exact Mass: 129.079
Source ID: CNP0148927.1
  • CAS Registry: 1723-00-8
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-11619
Kynurenine

Formula: C10H12N2O3
Exact Mass: 208.0848
Source ID: CNP0410940.1
  • CAS Registry: 343-65-7
  • KEGG: C01718
  • LipidMAPS:
  • BioCYC:
3-Hydroxyhippuric acid

Formula: C9H9NO4
Exact Mass: 195.0532
Source ID: CNP0348907.0
  • CAS Registry: 1637-75-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
trans-3-Hydroxycinnamate

Formula: C9H8O3
Exact Mass: 164.0473
Source ID: CNP0335428.0
  • CAS Registry: 14755-02-3
  • KEGG: C12621
  • LipidMAPS:
  • BioCYC:
3,4,5-Trimethoxycinnamic acid

Formula: C12H14O5
Exact Mass: 238.0841
Source ID: CNP0111810.0
  • CAS Registry: 90-50-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
6'-Hydroxyangolensin

Formula: C16H16O5
Exact Mass: 288.0998
Source ID: CNP0084814.0
  • CAS Registry: 204197-90-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Vanilloylglycine

Formula: C10H11NO5
Exact Mass: 225.0637
Source ID: CNP0320579.0
  • CAS Registry: 1212-04-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
O-Desmethylangolensin

Formula: C15H14O4
Exact Mass: 258.0892
Source ID: CNP0084684.0
  • CAS Registry: 21255-69-6
  • KEGG: C22559
  • LipidMAPS:
  • BioCYC:
Caffeic acid 3-O-sulfate

Formula: C9H8O7S
Exact Mass: 259.9991
Source ID: CNP0231113.0
  • CAS Registry: 151481-52-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Ferulic acid 4-O-sulfate

Formula: C10H10O7S
Exact Mass: 274.0147
Source ID: CNP0255753.0
  • CAS Registry: 151481-53-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Anandamide

Formula: C22H37NO2
Exact Mass: 347.2824
Source ID: CNP0226272.0
  • CAS Registry: 94421-68-8
  • KEGG: C11695
  • LipidMAPS: LMFA08040001
  • BioCYC: CPD-7598
1,3,5-Trimethoxybenzene

Formula: C9H12O3
Exact Mass: 168.0786
Source ID: CNP0284353.0
  • CAS Registry: 621-23-8
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-9500
2-Furoate

Formula: C5H4O3
Exact Mass: 112.016
Source ID: CNP0264313.0
  • CAS Registry: 88-14-2
  • KEGG: C01546
  • LipidMAPS:
  • BioCYC:
6'-Hydroxy-O-desmethylangolensin

Formula: C15H14O5
Exact Mass: 274.0841
Source ID: CNP0131523.0
  • CAS Registry: 153409-52-0
  • KEGG: C22560
  • LipidMAPS:
  • BioCYC:
Linoleoyl ethanolamide

Formula: C20H37NO2
Exact Mass: 323.2824
Source ID: CNP0187671.0
  • CAS Registry: 68171-52-8
  • KEGG:
  • LipidMAPS: LMFA08040004
  • BioCYC: CPD6666-4
Homovanillic acid sulfate

Formula: C9H10O7S
Exact Mass: 262.0147
Source ID: CNP0084971.0
  • CAS Registry: 38339-06-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Enterodiol

Formula: C18H22O4
Exact Mass: 302.1518
Source ID: CNP0334199.1
  • CAS Registry: 80226-00-2
  • KEGG: C18166
  • LipidMAPS:
  • BioCYC: CPD-24411
3-(3-Hydroxyphenyl)-3-hydroxypropanoic acid

Formula: C9H10O4
Exact Mass: 182.0579
Source ID: CNP0083903.0
  • CAS Registry: 3247-75-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Vanillactic acid

Formula: C10H12O5
Exact Mass: 212.0685
Source ID: CNP0084890.0
  • CAS Registry: 2475-56-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Hydroxyanthranilate

Formula: C7H7NO3
Exact Mass: 153.0426
Source ID: CNP0324729.0
  • CAS Registry: 548-93-6
  • KEGG: C00632
  • LipidMAPS:
  • BioCYC: 3-HYDROXY-ANTHRANILATE
(S)-Lactate

Formula: C3H6O3
Exact Mass: 90.0317
Source ID: CNP0232038.1
  • CAS Registry: 79-33-4
  • KEGG: C00186
  • LipidMAPS:
  • BioCYC: CPD-24844
Alanine

Formula: C3H7NO2
Exact Mass: 89.0477
Source ID: CNP0226336.0
  • CAS Registry: 302-72-7
  • KEGG: C01401
  • LipidMAPS:
  • BioCYC: L-ALPHA-ALANINE
Indole-3-acetaldehyde

Formula: C10H9NO
Exact Mass: 159.0684
Source ID: CNP0203676.0
  • CAS Registry: 2591-98-2
  • KEGG: C00637
  • LipidMAPS:
  • BioCYC: INDOLE_ACETALDEHYDE
D-Ribulose 5-phosphate

Formula: C5H11O8P
Exact Mass: 230.0192
Source ID: CNP0198905.1
  • CAS Registry: 551-85-9
  • KEGG: C00199
  • LipidMAPS:
  • BioCYC: RIBULOSE-5P
4-O-Methylgallic acid

Formula: C8H8O5
Exact Mass: 184.0372
Source ID: CNP0151030.0
  • CAS Registry: 4319-02-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
7,8,3',4'-Tetrahydroxyisoflavone

Formula: C15H10O6
Exact Mass: 286.0477
Source ID: CNP0350336.0
  • CAS Registry: 176786-87-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-(3-Hydroxyphenyl)propanoic acid

Formula: C9H10O3
Exact Mass: 166.063
Source ID: CNP0166101.0
  • CAS Registry: 621-54-5
  • KEGG: C11457
  • LipidMAPS:
  • BioCYC: 3-HYDROXYPHENYL-PROPIONATE
3,4-Dihydroxyphenylpropanoate

Formula: C9H10O4
Exact Mass: 182.0579
Source ID: CNP0265756.0
  • CAS Registry: 1078-61-1
  • KEGG: C10447
  • LipidMAPS:
  • BioCYC:
Anthranilate

Formula: C7H7NO2
Exact Mass: 137.0477
Source ID: CNP0152283.0
  • CAS Registry: 118-92-3
  • KEGG: C00108
  • LipidMAPS:
  • BioCYC: ANTHRANILATE
Pyrrole-2-carboxylate

Formula: C5H5NO2
Exact Mass: 111.032
Source ID: CNP0331002.0
  • CAS Registry: 634-97-9
  • KEGG: C05942
  • LipidMAPS:
  • BioCYC:
gamma-Butyrolactone

Formula: C4H6O2
Exact Mass: 86.0368
Source ID: CNP0315299.0
  • CAS Registry: 96-48-0
  • KEGG: C01770
  • LipidMAPS: LMFA07040004
  • BioCYC:
3-Hydroxyphenylacetate

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0342864.0
  • CAS Registry: 621-37-4
  • KEGG: C05593
  • LipidMAPS:
  • BioCYC: 3-HYDROXYPHENYLACETATE
9-Hydroxyphenanthrene

Formula: C14H10O
Exact Mass: 194.0732
Source ID: CNP0210210.0
  • CAS Registry: 484-17-3
  • KEGG: C11430
  • LipidMAPS:
  • BioCYC:
Dihydroferulic acid

Formula: C10H12O4
Exact Mass: 196.0736
Source ID: CNP0327265.0
  • CAS Registry: 1135-23-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Phenylacetylglycine

Formula: C10H11NO3
Exact Mass: 193.0739
Source ID: CNP0183978.0
  • CAS Registry: 500-98-1
  • KEGG: C05598
  • LipidMAPS:
  • BioCYC: CPD-11715
3,4-O-Dimethylgallic acid

Formula: C9H10O5
Exact Mass: 198.0528
Source ID: CNP0285876.0
  • CAS Registry: 1916-08-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-(3,4,5-Trimethoxyphenyl)propanoic acid

Formula: C12H16O5
Exact Mass: 240.0998
Source ID: CNP0423577.0
  • CAS Registry: 25173-72-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
alpha-D-Glucose

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0210547.11
  • CAS Registry: 492-62-6
  • KEGG: C00267
  • LipidMAPS:
  • BioCYC: ALPHA-GLUCOSE
(-)-Borneol

Formula: C10H18O
Exact Mass: 154.1358
Source ID: CNP0259481.4
  • CAS Registry: 464-45-9
  • KEGG: C01766
  • LipidMAPS: LMPR0102120004
  • BioCYC: CPD-1908
12-Methyltridecanoic acid

Formula: C14H28O2
Exact Mass: 228.2089
Source ID: CNP0189217.0
  • CAS Registry: 2724-57-4
  • KEGG:
  • LipidMAPS: LMFA01020007
  • BioCYC:
Rosmarinate

Formula: C18H16O8
Exact Mass: 360.0845
Source ID: CNP0243825.3
  • CAS Registry: 20283-92-5
  • KEGG: C01850
  • LipidMAPS:
  • BioCYC: CPD-6981
Melanin

Formula: C18H10N2O4
Exact Mass: 318.0641
Source ID: CNP0301754.0
  • CAS Registry: 8049-97-6
  • KEGG: C05606
  • LipidMAPS:
  • BioCYC: MELANIN
L-Hydroxylysine

Formula: C6H14N2O3
Exact Mass: 162.1004
Source ID: CNP0308911.1
  • CAS Registry: 1190-94-9
  • KEGG: C16741
  • LipidMAPS:
  • BioCYC: CPD-14226
L-Tyrosine

Formula: C9H11NO3
Exact Mass: 181.0739
Source ID: CNP0116237.1
  • CAS Registry: 60-18-4
  • KEGG: C00082
  • LipidMAPS:
  • BioCYC: TYR
Phenylpropanoate

Formula: C9H10O2
Exact Mass: 150.0681
Source ID: CNP0298094.0
  • CAS Registry: 501-52-0
  • KEGG: C05629
  • LipidMAPS:
  • BioCYC: 3-PHENYLPROPIONATE
N-Acetylserotonin

Formula: C12H14N2O2
Exact Mass: 218.1055
Source ID: CNP0298476.0
  • CAS Registry: 1210-83-9
  • KEGG: C00978
  • LipidMAPS:
  • BioCYC: N-ACETYL-SEROTONIN
3-Aminosalicylic acid

Formula: C7H7NO3
Exact Mass: 153.0426
Source ID: CNP0299279.0
  • CAS Registry: 570-23-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Hydroxyhippuric acid

Formula: C9H9NO4
Exact Mass: 195.0532
Source ID: CNP0422796.0
  • CAS Registry: 2482-25-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Campesterol

Formula: C28H48O
Exact Mass: 400.3705
Source ID: CNP0291093.3
  • CAS Registry: 474-62-4
  • KEGG: C01789
  • LipidMAPS: LMST01030096
  • BioCYC: CPD-707
Pentadecanoic acid

Formula: C15H30O2
Exact Mass: 242.2246
Source ID: CNP0296248.0
  • CAS Registry: 1002-84-2
  • KEGG: C16537
  • LipidMAPS: LMFA01010015
  • BioCYC:
5-Hydroxyindoleacetate

Formula: C10H9NO3
Exact Mass: 191.0582
Source ID: CNP0160237.0
  • CAS Registry: 54-16-0
  • KEGG: C05635
  • LipidMAPS:
  • BioCYC: 5-HYDROXYINDOLE_ACETATE
5,6-Dihydrothymine

Formula: C5H8N2O2
Exact Mass: 128.0586
Source ID: CNP0349997.0
  • CAS Registry: 696-04-8
  • KEGG: C00906
  • LipidMAPS:
  • BioCYC: DIHYDRO-THYMINE
Bilirubin

Formula: C33H36N4O6
Exact Mass: 584.2635
Source ID: CNP0254882.0
  • CAS Registry: 635-65-4
  • KEGG: C00486
  • LipidMAPS:
  • BioCYC: BILIRUBIN
Choline phosphate

Formula: C5H15NO4P
Exact Mass: 184.0739
Source ID: CNP0191945.0
  • CAS Registry: 107-73-3
  • KEGG: C00588
  • LipidMAPS:
  • BioCYC:
Azelaic acid

Formula: C9H16O4
Exact Mass: 188.1049
Source ID: CNP0225848.0
  • CAS Registry: 123-99-9
  • KEGG: C08261
  • LipidMAPS: LMFA01170054
  • BioCYC: CPD0-1265
Quetiapine

Formula: C21H25N3O2S
Exact Mass: 383.1667
Source ID: CNP0347286.0
  • CAS Registry: 111974-69-7
  • KEGG: C07397
  • LipidMAPS:
  • BioCYC:
Farnesol

Formula: C15H26O
Exact Mass: 222.1984
Source ID: CNP0232612.0
  • CAS Registry: 4602-84-0
  • KEGG: C06081
  • LipidMAPS:
  • BioCYC:
Xanthurenic acid

Formula: C10H7NO4
Exact Mass: 205.0375
Source ID: CNP0314213.0
  • CAS Registry: 59-00-7
  • KEGG: C02470
  • LipidMAPS:
  • BioCYC: XANTHURENATE
TG(14:0/14:0/14:0)

Formula: C45H86O6
Exact Mass: 722.6424
Source ID: CNP0148295.0
  • CAS Registry: 555-45-3
  • KEGG:
  • LipidMAPS: LMGL03012616
  • BioCYC:
Glutathione disulfide

Formula: C20H32N6O12S2
Exact Mass: 612.152
Source ID: CNP0102794.1
  • CAS Registry: 27025-41-8
  • KEGG: C00127
  • LipidMAPS:
  • BioCYC: OXIDIZED-GLUTATHIONE
3,5-Diiodo-L-tyrosine

Formula: C9H9I2NO3
Exact Mass: 432.8672
Source ID: CNP0246057.1
  • CAS Registry: 300-39-0
  • KEGG: C01060
  • LipidMAPS:
  • BioCYC:
2-Linoleoyl Glycerol

Formula: C21H38O4
Exact Mass: 354.277
Source ID: CNP0352297.0
  • CAS Registry: 3443-82-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Oleamide

Formula: C18H35NO
Exact Mass: 281.2719
Source ID: CNP0300480.0
  • CAS Registry: 301-02-0
  • KEGG: C19670
  • LipidMAPS: LMFA08010004
  • BioCYC: CPD6666-1
Octadeca-10,12-dienoic acid

Formula: C18H32O2
Exact Mass: 280.2402
Source ID: CNP0212832.0
  • CAS Registry: 2420-56-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
cis-Vaccenic acid

Formula: C18H34O2
Exact Mass: 282.2559
Source ID: CNP0182779.0
  • CAS Registry: 506-17-2
  • KEGG: C21944
  • LipidMAPS: LMFA01030076
  • BioCYC:
9-OxoODE

Formula: C18H30O3
Exact Mass: 294.2195
Source ID: CNP0191563.0
  • CAS Registry: 54232-59-6
  • KEGG: C14766
  • LipidMAPS: LMFA02000274
  • BioCYC:
Oleoyl glycine

Formula: C20H37NO3
Exact Mass: 339.2773
Source ID: CNP0154928.0
  • CAS Registry: 2601-90-3
  • KEGG:
  • LipidMAPS: LMFA08020082
  • BioCYC:
Erucic acid

Formula: C22H42O2
Exact Mass: 338.3185
Source ID: CNP0242452.0
  • CAS Registry: 112-86-7
  • KEGG: C08316
  • LipidMAPS: LMFA01030090
  • BioCYC: CPD-14292
Hexadecanedioate

Formula: C16H30O4
Exact Mass: 286.2144
Source ID: CNP0211094.0
  • CAS Registry: 505-54-4
  • KEGG: C19615
  • LipidMAPS: LMFA01170022
  • BioCYC: CPD-10511
13-OxoODE

Formula: C18H30O3
Exact Mass: 294.2195
Source ID: CNP0389625.0
  • CAS Registry: 54739-30-9
  • KEGG: C14765
  • LipidMAPS: LMFA02000016
  • BioCYC:
10Z-Nonadecenoic acid

Formula: C19H36O2
Exact Mass: 296.2715
Source ID: CNP0256208.0
  • CAS Registry: 73033-09-7
  • KEGG:
  • LipidMAPS: LMFA01030362
  • BioCYC:
12(13)Ep-9-KODE

Formula: C18H30O4
Exact Mass: 310.2144
Source ID: CNP0254173.0
  • CAS Registry: 478931-82-7
  • KEGG:
  • LipidMAPS: LMFA02000247
  • BioCYC:
Rumenic acid

Formula: C18H32O2
Exact Mass: 280.2402
Source ID: CNP0416601.0
  • CAS Registry: 2540-56-9
  • KEGG: C04056
  • LipidMAPS: LMFA01030118
  • BioCYC:
Dihomo--linolenic acid

Formula: C20H34O2
Exact Mass: 306.2559
Source ID: CNP0234935.0
  • CAS Registry: 7324-41-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
tetracos-15-enoic acid

Formula: C24H46O2
Exact Mass: 366.3498
Source ID: CNP0360205.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Adrenic acid

Formula: C22H36O2
Exact Mass: 332.2715
Source ID: CNP0337651.0
  • CAS Registry: 28874-58-0
  • KEGG: C16527
  • LipidMAPS: LMFA01030178
  • BioCYC:
9-Octadecenamide, N-(2-hydroxyethyl)-, (9Z)-

Formula: C20H39NO2
Exact Mass: 325.2981
Source ID: CNP0367242.0
  • CAS Registry: 111-58-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
10Z-Heptadecenoic acid

Formula: C17H32O2
Exact Mass: 268.2402
Source ID: CNP0150109.0
  • CAS Registry: 29743-97-3
  • KEGG:
  • LipidMAPS: LMFA01030283
  • BioCYC:
12-OxoETE

Formula: C20H30O3
Exact Mass: 318.2195
Source ID: CNP0285442.0
  • CAS Registry: 108437-64-5
  • KEGG: C14807
  • LipidMAPS: LMFA03060019
  • BioCYC:
Eicosa-5,8,11,14-tetraenoic acid 1,3-dihydroxypropan-2-yl ester

Formula: C23H38O4
Exact Mass: 378.277
Source ID: CNP0288883.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
7,10,13,16,19-Docosapentaenoic acid

Formula: C22H34O2
Exact Mass: 330.2559
Source ID: CNP0268115.0
  • CAS Registry: 2234-74-4
  • KEGG:
  • LipidMAPS: LMFA01030184
  • BioCYC:
Oleyl alcohol

Formula: C18H36O
Exact Mass: 268.2766
Source ID: CNP0282006.0
  • CAS Registry: 143-28-2
  • KEGG:
  • LipidMAPS: LMFA05000213
  • BioCYC:
Ethyl hexadecanoate

Formula: C18H36O2
Exact Mass: 284.2715
Source ID: CNP0248873.0
  • CAS Registry: 628-97-7
  • KEGG:
  • LipidMAPS: LMFA07010471
  • BioCYC: CPD-19848
Traumatic acid

Formula: C12H20O4
Exact Mass: 228.1362
Source ID: CNP0293905.0
  • CAS Registry: 6402-36-4
  • KEGG: C16308
  • LipidMAPS: LMFA01170002
  • BioCYC:
Undecanedioic acid

Formula: C11H20O4
Exact Mass: 216.1362
Source ID: CNP0292095.0
  • CAS Registry: 1852-04-6
  • KEGG:
  • LipidMAPS: LMFA01170007
  • BioCYC:
Ethyl octadeca-9,12,15-trienoate

Formula: C20H34O2
Exact Mass: 306.2559
Source ID: CNP0216121.0
  • CAS Registry: 1191-41-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-OxoETE

Formula: C20H30O3
Exact Mass: 318.2195
Source ID: CNP0266081.0
  • CAS Registry: 126432-17-5
  • KEGG: C14732
  • LipidMAPS: LMFA03060011
  • BioCYC:
Carboxy-ibuprofen

Formula: C13H16O4
Exact Mass: 236.1049
Source ID: CNP0081898.0
  • CAS Registry: 15935-54-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Hexyl-3-phenyl-2-propenal

Formula: C15H20O
Exact Mass: 216.1514
Source ID: CNP0311789.0
  • CAS Registry: 101-86-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
8-HYDROXYDOCOSA-4,6,10,13,16,19-HEXAENOIC ACID

Formula: C22H32O3
Exact Mass: 344.2351
Source ID: CNP0477592.0
  • CAS Registry: 90780-54-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Elaidic carnitine

Formula: C25H47NO4
Exact Mass: 425.3505
Source ID: CNP0568878.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMFA07070063
  • BioCYC:
(+/-)14(15)-DiHETE

Formula: C20H32O4
Exact Mass: 336.23
Source ID: CNP0084942.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
8(S)-HETrE

Formula: C20H34O3
Exact Mass: 322.2508
Source ID: CNP0347062.0
  • CAS Registry: NA
  • KEGG:
  • LipidMAPS: LMFA03050029
  • BioCYC:
(5Z,8Z,11Z,14Z)-Ethyl icosa-5,8,11,14-tetraenoate

Formula: C22H36O2
Exact Mass: 332.2715
Source ID: CNP0234579.0
  • CAS Registry: 95285-77-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Eicosa-11,14,17-trienoic acid

Formula: C20H34O2
Exact Mass: 306.2559
Source ID: CNP0231675.0
  • CAS Registry: 2091-27-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(5Z,8Z,11Z,14Z)-Methyl icosa-5,8,11,14-tetraenoate

Formula: C21H34O2
Exact Mass: 318.2559
Source ID: CNP0235885.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-(3,4-dimethoxyphenyl)prop-2-enoic acid

Formula: C11H12O4
Exact Mass: 208.0736
Source ID: CNP0235910.0
  • CAS Registry: 2316-26-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
7-Ketocholesterol

Formula: C27H44O2
Exact Mass: 400.3341
Source ID: CNP0206144.1
  • CAS Registry: 566-28-9
  • KEGG:
  • LipidMAPS: LMST01010049
  • BioCYC: CPD-14195
3-hydroxyhexadecanoyl carnitine

Formula: C23H45NO5
Exact Mass: 415.3298
Source ID: CNP0532940.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Hydroxy-3-methylbenzoate

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0305353.0
  • CAS Registry: 499-76-3
  • KEGG: C21167
  • LipidMAPS:
  • BioCYC:


Formula: C22H32O3
Exact Mass: 344.2351
Source ID: CNP0350210.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
7,10,13,16-Docosatetraenoylethanolamine

Formula: C24H41NO2
Exact Mass: 375.3137
Source ID: CNP0346998.0
  • CAS Registry: 150314-35-5
  • KEGG: C13829
  • LipidMAPS: LMFA08040047
  • BioCYC:
N-Arachidonoyl Glycine

Formula: C22H35NO3
Exact Mass: 361.2617
Source ID: CNP0347003.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Pyridoxate

Formula: C8H9NO4
Exact Mass: 183.0532
Source ID: CNP0244996.0
  • CAS Registry: 82-82-6
  • KEGG: C00847
  • LipidMAPS:
  • BioCYC: CPD-1112
5'-Methylthioadenosine

Formula: C11H15N5O3S
Exact Mass: 297.0896
Source ID: CNP0141020.1
  • CAS Registry: 2457-80-9
  • KEGG: C00170
  • LipidMAPS:
  • BioCYC: 5-METHYLTHIOADENOSINE
Pyridoxal

Formula: C8H9NO3
Exact Mass: 167.0582
Source ID: CNP0119632.0
  • CAS Registry: 66-72-8
  • KEGG: C00250
  • LipidMAPS:
  • BioCYC: PYRIDOXAL
beta-Carboline

Formula: C11H8N2
Exact Mass: 168.0687
Source ID: CNP0135748.0
  • CAS Registry: 244-63-3
  • KEGG: C20157
  • LipidMAPS:
  • BioCYC: CPD-15304
Pyridoxamine phosphate

Formula: C8H13N2O5P
Exact Mass: 248.0562
Source ID: CNP0085559.0
  • CAS Registry: 529-96-4
  • KEGG: C00647
  • LipidMAPS:
  • BioCYC:
N-Methyltryptamine

Formula: C11H14N2
Exact Mass: 174.1157
Source ID: CNP0113759.0
  • CAS Registry: 61-49-4
  • KEGG: C06213
  • LipidMAPS:
  • BioCYC:
4-Hydroxydebrisoquine

Formula: C10H13N3O
Exact Mass: 191.1059
Source ID: CNP0215952.0
  • CAS Registry: 59333-79-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
131339-24-7

Formula: C20H30O3
Exact Mass: 318.2195
Source ID: CNP0347425.0
  • CAS Registry: 504435-15-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Gabapentin

Formula: C9H17NO2
Exact Mass: 171.1259
Source ID: CNP0330356.0
  • CAS Registry: 60142-96-3
  • KEGG: C07018
  • LipidMAPS:
  • BioCYC: CPD-16562
2-[2-({1-[2-(2-{2-[(1-{[1-(2-amino-5-carbamimidamidopentanoyl)pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl)formamido]acetamido}-3-phenylpropanamido)-3-hydroxypropanoyl]pyrrolidin-2-yl}formamido)-3-phenylpropanamido]-5-carbamimidamidopentanoic acid

Formula: C50H73N15O11
Exact Mass: 1059.5614
Source ID: CNP0147621.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Chlorhexidine

Formula: C22H30Cl2N10
Exact Mass: 504.2032
Source ID: CNP0539045.0
  • CAS Registry: 55-56-1
  • KEGG: C06902
  • LipidMAPS:
  • BioCYC: CPD-20896
N1-Acetylspermine

Formula: C12H28N4O
Exact Mass: 244.2263
Source ID: CNP0347342.0
  • CAS Registry: 25593-72-0
  • KEGG: C02567
  • LipidMAPS:
  • BioCYC: N1-ACETYLSPERMINE
Ranisen

Formula: C13H22N4O3S
Exact Mass: 314.1413
Source ID: CNP0577830.0
  • CAS Registry: 66357-35-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-Acetyl-L-phenylalanine

Formula: C11H13NO3
Exact Mass: 207.0895
Source ID: CNP0317748.1
  • CAS Registry: 2018-61-3
  • KEGG: C03519
  • LipidMAPS:
  • BioCYC: CPD-439
Kynurenine

Formula: C10H12N2O3
Exact Mass: 208.0848
Source ID: CNP0410940.2
  • CAS Registry: 343-65-7
  • KEGG: C01718
  • LipidMAPS:
  • BioCYC:
Homoarginine

Formula: C7H16N4O2
Exact Mass: 188.1273
Source ID: CNP0513488.1
  • CAS Registry: 156-86-5
  • KEGG: C01924
  • LipidMAPS:
  • BioCYC:
N-Acetyl-alpha-D-glucosamine 1-phosphate

Formula: C8H16NO9P
Exact Mass: 301.0563
Source ID: CNP0160713.1
  • CAS Registry: 6866-69-9
  • KEGG: C04501
  • LipidMAPS:
  • BioCYC:
5Z-Dodecenoic acid

Formula: C12H22O2
Exact Mass: 198.162
Source ID: CNP0163257.0
  • CAS Registry: 2430-94-6
  • KEGG:
  • LipidMAPS: LMFA01030226
  • BioCYC:
15-OxoETE

Formula: C20H30O3
Exact Mass: 318.2195
Source ID: CNP0346910.0
  • CAS Registry: 81416-72-0
  • KEGG: C04577
  • LipidMAPS: LMFA03060051
  • BioCYC:
N2-Acetyl-L-lysine

Formula: C8H16N2O3
Exact Mass: 188.1161
Source ID: CNP0129827.1
  • CAS Registry: 1946-82-3
  • KEGG: C12989
  • LipidMAPS:
  • BioCYC:
PD049029

Formula: C23H38O5
Exact Mass: 394.2719
Source ID: CNP0081985.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(+/-)17(18)-DiHETE

Formula: C20H32O4
Exact Mass: 336.23
Source ID: CNP0227860.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
9-HEPE

Formula: C20H30O3
Exact Mass: 318.2195
Source ID: CNP0461137.0
  • CAS Registry: 286390-03-2
  • KEGG:
  • LipidMAPS: LMFA03070029
  • BioCYC:
19(20)-EpDPE

Formula: C22H32O3
Exact Mass: 344.2351
Source ID: CNP0154341.0
  • CAS Registry: NA
  • KEGG:
  • LipidMAPS: LMFA04000038
  • BioCYC:
Famotidine

Formula: C8H15N7O2S3
Exact Mass: 337.0449
Source ID: CNP0580238.0
  • CAS Registry: 76824-35-6
  • KEGG: D00318
  • LipidMAPS:
  • BioCYC:
L-Adrenaline

Formula: C9H13NO3
Exact Mass: 183.0895
Source ID: CNP0255612.1
  • CAS Registry: 51-43-4
  • KEGG: C00788
  • LipidMAPS:
  • BioCYC: L-EPINEPHRINE
D-Glucarate

Formula: C6H10O8
Exact Mass: 210.0376
Source ID: CNP0223776.1
  • CAS Registry: 87-73-0
  • KEGG: C00818
  • LipidMAPS: LMFA01170108
  • BioCYC: D-GLUCARATE
Protoporphyrin

Formula: C34H34N4O4
Exact Mass: 562.258
Source ID: CNP0277227.0
  • CAS Registry: 553-12-8
  • KEGG: C02191
  • LipidMAPS:
  • BioCYC: PROTOPORPHYRIN_IX
Epietiocholanolone

Formula: C19H30O2
Exact Mass: 290.2246
Source ID: CNP0199434.1
  • CAS Registry: 571-31-3
  • KEGG:
  • LipidMAPS: LMST02020104
  • BioCYC:
acetylarginine

Formula: C8H16N4O3
Exact Mass: 216.1222
Source ID: CNP0516495.0
  • CAS Registry: 35436-73-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-Acetyl-L-glutamate

Formula: C7H11NO5
Exact Mass: 189.0637
Source ID: CNP0124986.1
  • CAS Registry: 1188-37-0
  • KEGG: C00624
  • LipidMAPS:
  • BioCYC: ACETYL-GLU
Desmethylranitidine

Formula: C12H20N4O3S
Exact Mass: 300.1256
Source ID: CNP0491258.0
  • CAS Registry: 66357-25-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
20-Hydroxyarachlidonic acid

Formula: C20H32O3
Exact Mass: 320.2351
Source ID: CNP0147200.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5,8,11,14-Hexadecatetraenoicacid, 16-[(2R,3S)-3-ethyl-2-oxiranyl]-, (5Z,8Z,11Z,14Z)-rel-

Formula: C20H30O3
Exact Mass: 318.2195
Source ID: CNP0127519.0
  • CAS Registry: 131339-23-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Methoxytryptamine

Formula: C11H14N2O
Exact Mass: 190.1106
Source ID: CNP0333514.0
  • CAS Registry: 608-07-1
  • KEGG: C05659
  • LipidMAPS:
  • BioCYC:
16-HYDROXYDOCOSA-4,7,10,13,17,19-HEXAENOIC ACID

Formula: C22H32O3
Exact Mass: 344.2351
Source ID: CNP0318823.0
  • CAS Registry: 90780-51-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Naphthol

Formula: C10H8O
Exact Mass: 144.0575
Source ID: CNP0302215.0
  • CAS Registry: 90-15-3
  • KEGG: C11714
  • LipidMAPS:
  • BioCYC: NAPHTHOL
Pyridoxamine

Formula: C8H12N2O2
Exact Mass: 168.0899
Source ID: CNP0195117.0
  • CAS Registry: 85-87-0
  • KEGG: C00534
  • LipidMAPS:
  • BioCYC: PYRIDOXAMINE
(2S,5R)-2,6-Diamino-5-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoic acid

Formula: C12H24N2O8
Exact Mass: 324.1533
Source ID: CNP0290574.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,5-di-tert-Butyl-1,4-benzoquinone

Formula: C14H20O2
Exact Mass: 220.1463
Source ID: CNP0260127.0
  • CAS Registry: 2460-77-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
gamma-CEHC

Formula: C15H20O4
Exact Mass: 264.1362
Source ID: CNP0084378.0
  • CAS Registry: 178167-75-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
8S,15S-DiHETE

Formula: C20H32O4
Exact Mass: 336.23
Source ID: CNP0347653.0
  • CAS Registry: 80234-65-7
  • KEGG:
  • LipidMAPS: LMFA03060050
  • BioCYC:
4-[3-(Tetradeca-2,5,8-trien-1-yl)oxiran-2-yl]butanoic acid

Formula: C20H32O3
Exact Mass: 320.2351
Source ID: CNP0347674.0
  • CAS Registry: 81246-84-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Carboxy-4-methyl-5-propyl-2-furanpropionic acid

Formula: C12H16O5
Exact Mass: 240.0998
Source ID: CNP0304168.0
  • CAS Registry: 86879-39-2
  • KEGG:
  • LipidMAPS: LMFA01150004
  • BioCYC:
Eicosenoic acid

Formula: C20H38O2
Exact Mass: 310.2872
Source ID: CNP0264631.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Stearidonic acid

Formula: C18H28O2
Exact Mass: 276.2089
Source ID: CNP0156231.0
  • CAS Registry: 20290-75-9
  • KEGG: C16300
  • LipidMAPS: LMFA01030357
  • BioCYC: CPD-12653
Eicosadienoic acid

Formula: C20H36O2
Exact Mass: 308.2715
Source ID: CNP0151710.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
alpha-CEHC

Formula: C16H22O4
Exact Mass: 278.1518
Source ID: CNP0084959.0
  • CAS Registry: 4072-32-6
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-11962
16(17)-EpDPE

Formula: C22H32O3
Exact Mass: 344.2351
Source ID: CNP0091468.0
  • CAS Registry: NA
  • KEGG:
  • LipidMAPS: LMFA04000037
  • BioCYC:
20-HDoHE

Formula: C22H32O3
Exact Mass: 344.2351
Source ID: CNP0476742.0
  • CAS Registry: 90906-41-5
  • KEGG:
  • LipidMAPS: LMFA04000033
  • BioCYC:
19,20-DiHDPA

Formula: C22H34O4
Exact Mass: 362.2457
Source ID: CNP0335203.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMFA04000043
  • BioCYC:
13-HYDROXYDOCOSA-4,7,10,14,16,19-HEXAENOIC ACID

Formula: C22H32O3
Exact Mass: 344.2351
Source ID: CNP0082624.0
  • CAS Registry: 90780-53-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
ARGININOSUCCINATE

Formula: C10H18N4O6
Exact Mass: 290.1226
Source ID: CNP0503114.0
  • CAS Registry: 92008-07-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-butyl Oleate

Formula: C22H42O2
Exact Mass: 338.3185
Source ID: CNP0275629.0
  • CAS Registry: 142-77-8
  • KEGG:
  • LipidMAPS: LMFA07010975
  • BioCYC:
alpha-Amylcinnamaldehyde

Formula: C14H18O
Exact Mass: 202.1358
Source ID: CNP0243737.0
  • CAS Registry: 122-40-7
  • KEGG: C12288
  • LipidMAPS:
  • BioCYC:
Alpha-Linolenoyl ethanolamide

Formula: C20H35NO2
Exact Mass: 321.2668
Source ID: CNP0324768.0
  • CAS Registry: 57086-93-8
  • KEGG: C13828
  • LipidMAPS: LMFA08040007
  • BioCYC:
Ubiquinone-1

Formula: C14H18O4
Exact Mass: 250.1205
Source ID: CNP0339096.0
  • CAS Registry: 727-81-1
  • KEGG: C00399
  • LipidMAPS:
  • BioCYC: CPD0-1118
Palmitoylethanolamide

Formula: C18H37NO2
Exact Mass: 299.2824
Source ID: CNP0247367.0
  • CAS Registry: 544-31-0
  • KEGG: C16512
  • LipidMAPS: LMFA08040013
  • BioCYC: CPD-20399
Stearoylethanolamide

Formula: C20H41NO2
Exact Mass: 327.3137
Source ID: CNP0346699.0
  • CAS Registry: 111-57-9
  • KEGG:
  • LipidMAPS: LMFA08040051
  • BioCYC: CPD-20400
Tetradecanedioic acid

Formula: C14H26O4
Exact Mass: 258.1831
Source ID: CNP0288337.0
  • CAS Registry: 821-38-5
  • KEGG: C11002
  • LipidMAPS: LMFA01170018
  • BioCYC:
Hexaethylene glycol

Formula: C12H26O7
Exact Mass: 282.1678
Source ID: CNP0147909.0
  • CAS Registry: 2615-15-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Leucyl-leucine

Formula: C12H24N2O3
Exact Mass: 244.1787
Source ID: CNP0336094.1
  • CAS Registry: 2883-36-5
  • KEGG: C11332
  • LipidMAPS:
  • BioCYC:
Suberylglycine

Formula: C10H17NO5
Exact Mass: 231.1107
Source ID: CNP0346714.0
  • CAS Registry: 60317-54-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Hydroxytryptophol

Formula: C10H11NO2
Exact Mass: 177.079
Source ID: CNP0153274.0
  • CAS Registry: 154-02-9
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-11671
5'-Deoxyadenosine

Formula: C10H13N5O3
Exact Mass: 251.1018
Source ID: CNP0199646.1
  • CAS Registry: 4754-39-6
  • KEGG: C05198
  • LipidMAPS:
  • BioCYC: CH33ADO
Indole-3-propionic acid

Formula: C11H11NO2
Exact Mass: 189.079
Source ID: CNP0213541.0
  • CAS Registry: 830-96-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Nifedipine

Formula: C17H18N2O6
Exact Mass: 346.1165
Source ID: CNP0601416.0
  • CAS Registry: 21829-25-4
  • KEGG: C07266
  • LipidMAPS:
  • BioCYC: CPD-20503
Spermine

Formula: C10H26N4
Exact Mass: 202.2157
Source ID: CNP0224866.0
  • CAS Registry: 71-44-3
  • KEGG: C00750
  • LipidMAPS:
  • BioCYC: SPERMINE
Sphinganine

Formula: C18H39NO2
Exact Mass: 301.2981
Source ID: CNP0239767.1
  • CAS Registry: 764-22-7
  • KEGG: C00836
  • LipidMAPS: LMSP01020001
  • BioCYC: CPD-13612
3-Iodo-L-tyrosine

Formula: C9H10INO3
Exact Mass: 306.9705
Source ID: CNP0354293.1
  • CAS Registry: 70-78-0
  • KEGG: C02515
  • LipidMAPS:
  • BioCYC: CPD-12288
Monoisobutyl phthalic acid

Formula: C12H14O4
Exact Mass: 222.0892
Source ID: CNP0189299.0
  • CAS Registry: 30833-53-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Urate

Formula: C5H4N4O3
Exact Mass: 168.0283
Source ID: CNP0156874.0
  • CAS Registry: 69-93-2
  • KEGG: C00366
  • LipidMAPS:
  • BioCYC: URATE
Procaine

Formula: C13H20N2O2
Exact Mass: 236.1525
Source ID: CNP0336300.0
  • CAS Registry: 59-46-1
  • KEGG: C07375
  • LipidMAPS:
  • BioCYC:
N8-Acetylspermidine

Formula: C9H21N3O
Exact Mass: 187.1685
Source ID: CNP0348437.0
  • CAS Registry: 13431-24-8
  • KEGG: C01029
  • LipidMAPS:
  • BioCYC: CPD-3462
Tryptamine

Formula: C10H12N2
Exact Mass: 160.1
Source ID: CNP0329876.0
  • CAS Registry: 61-54-1
  • KEGG: C00398
  • LipidMAPS:
  • BioCYC: TRYPTAMINE
Deoxyadenosine

Formula: C10H13N5O3
Exact Mass: 251.1018
Source ID: CNP0224071.1
  • CAS Registry: 958-09-8
  • KEGG: C00559
  • LipidMAPS:
  • BioCYC: DEOXYADENOSINE
Heptaethylene glycol

Formula: C14H30O8
Exact Mass: 326.1941
Source ID: CNP0539173.0
  • CAS Registry: 5617-32-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tetrahydrocortisone

Formula: C21H32O5
Exact Mass: 364.225
Source ID: CNP0235987.1
  • CAS Registry: 53-05-4
  • KEGG: C05470
  • LipidMAPS: LMST02030098
  • BioCYC: UROCORTISONE
1,6-Di-O-phosphono-D-fructose

Formula: C6H14O12P2
Exact Mass: 339.9961
Source ID: CNP0313612.1
  • CAS Registry: 488-69-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-Acetyl-L-aspartate

Formula: C6H9NO5
Exact Mass: 175.0481
Source ID: CNP0142168.1
  • CAS Registry: 997-55-7
  • KEGG: C01042
  • LipidMAPS:
  • BioCYC: CPD-420
Methyl tetradecanoate

Formula: C15H30O2
Exact Mass: 242.2246
Source ID: CNP0250171.0
  • CAS Registry: 124-10-7
  • KEGG:
  • LipidMAPS: LMFA07010467
  • BioCYC:
3-Ureidopropionate

Formula: C4H8N2O3
Exact Mass: 132.0535
Source ID: CNP0350035.0
  • CAS Registry: 462-88-4
  • KEGG: C02642
  • LipidMAPS:
  • BioCYC: 3-UREIDO-PROPIONATE
Quinolinate

Formula: C7H5NO4
Exact Mass: 167.0219
Source ID: CNP0106280.0
  • CAS Registry: 89-00-9
  • KEGG: C03722
  • LipidMAPS:
  • BioCYC:
beta-Alanyl-N(pi)-methyl-L-histidine

Formula: C10H16N4O3
Exact Mass: 240.1222
Source ID: CNP0209872.1
  • CAS Registry: 584-85-0
  • KEGG: C01262
  • LipidMAPS:
  • BioCYC: CPD-401
Tridecanoic acid

Formula: C13H26O2
Exact Mass: 214.1933
Source ID: CNP0145185.0
  • CAS Registry: 638-53-9
  • KEGG: C17076
  • LipidMAPS: LMFA01010013
  • BioCYC:
Dodecanedioic acid

Formula: C12H22O4
Exact Mass: 230.1518
Source ID: CNP0293008.0
  • CAS Registry: 693-23-2
  • KEGG: C02678
  • LipidMAPS: LMFA01170009
  • BioCYC: CPD-10670
6-Aminohexanoate

Formula: C6H13NO2
Exact Mass: 131.0946
Source ID: CNP0337210.0
  • CAS Registry: 60-32-2
  • KEGG: C02378
  • LipidMAPS: LMFA01100035
  • BioCYC: CPD-884
Nandrolone

Formula: C18H26O2
Exact Mass: 274.1933
Source ID: CNP0168004.1
  • CAS Registry: 434-22-0
  • KEGG: C07254
  • LipidMAPS: LMST02010044
  • BioCYC: CPD-23348
6-Hydroxymelatonin

Formula: C13H16N2O3
Exact Mass: 248.1161
Source ID: CNP0349869.0
  • CAS Registry: 2208-41-5
  • KEGG: C05643
  • LipidMAPS:
  • BioCYC: CPD-12014
[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-hydroxy-2-imino-3H-purin-9-yl)oxolan-2-yl]methyl phosphono hydrogen phosphate

Formula: C10H15N5O11P2
Exact Mass: 443.0243
Source ID: CNP0586953.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Sphingosine

Formula: C18H37NO2
Exact Mass: 299.2824
Source ID: CNP0149684.1
  • CAS Registry: 123-78-4
  • KEGG: C00319
  • LipidMAPS: LMSP01010001
  • BioCYC: SPHINGOSINE
Nicotinurate

Formula: C8H8N2O3
Exact Mass: 180.0535
Source ID: CNP0229746.0
  • CAS Registry: 583-08-4
  • KEGG: C05380
  • LipidMAPS:
  • BioCYC:
Palmitoylglycine

Formula: C18H35NO3
Exact Mass: 313.2617
Source ID: CNP0346946.0
  • CAS Registry: 158305-64-7
  • KEGG:
  • LipidMAPS: LMFA08020079
  • BioCYC:
Kaempferol 3-glucuronide

Formula: C21H18O12
Exact Mass: 462.0798
Source ID: CNP0263661.1
  • CAS Registry: 22688-78-4
  • KEGG:
  • LipidMAPS: LMPK12111843
  • BioCYC:
Methyl palmitate

Formula: C17H34O2
Exact Mass: 270.2559
Source ID: CNP0274232.0
  • CAS Registry: 112-39-0
  • KEGG: C16995
  • LipidMAPS: LMFA07010470
  • BioCYC: Methylhexadecanoates
9-Nitro-octadeca-9-enoic acid

Formula: C18H33NO4
Exact Mass: 327.2409
Source ID: CNP0600513.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
7-hydroxydocosa-4,8,10,13,16,19-hexaenoic acid

Formula: C22H32O3
Exact Mass: 344.2351
Source ID: CNP0228146.0
  • CAS Registry: 90780-55-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Oxo-2-nonenal

Formula: C9H14O2
Exact Mass: 154.0994
Source ID: CNP0346772.0
  • CAS Registry: 103560-62-9
  • KEGG:
  • LipidMAPS: LMFA06000254
  • BioCYC:
Cis-8,11,14,17-Eicosatetraenoic acid

Formula: C20H32O2
Exact Mass: 304.2402
Source ID: CNP0407826.0
  • CAS Registry: 2091-26-1
  • KEGG:
  • LipidMAPS: LMFA01030818
  • BioCYC: CPD-8121
8,11,14-Eicosatrienoylethanolamide

Formula: C22H39NO2
Exact Mass: 349.2981
Source ID: CNP0362593.0
  • CAS Registry: 150314-34-4
  • KEGG: C13828
  • LipidMAPS: LMFA08040011
  • BioCYC:
Docosatrienoic acid

Formula: C22H38O2
Exact Mass: 334.2872
Source ID: CNP0399389.0
  • CAS Registry: 28845-86-5
  • KEGG:
  • LipidMAPS: LMFA01030408
  • BioCYC:
Isooctadecanoic acid

Formula: C18H36O2
Exact Mass: 284.2715
Source ID: CNP0221763.0
  • CAS Registry: 2724-58-5
  • KEGG: C20356
  • LipidMAPS: LMFA01020014
  • BioCYC:
11-Eicosatrienoic acid

Formula: C20H34O2
Exact Mass: 306.2559
Source ID: CNP0325773.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Hydroxyfluorene

Formula: C13H10O
Exact Mass: 182.0732
Source ID: CNP0203564.0
  • CAS Registry: 2443-58-5
  • KEGG: C14460
  • LipidMAPS:
  • BioCYC:
N-amidinoaspartic acid

Formula: C5H9N3O4
Exact Mass: 175.0593
Source ID: CNP0515387.0
  • CAS Registry: 6133-30-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-acetyl-5-aminosalicylic acid

Formula: C9H9NO4
Exact Mass: 195.0532
Source ID: CNP0139597.0
  • CAS Registry: 51-59-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Monobutylphthalate

Formula: C12H14O4
Exact Mass: 222.0892
Source ID: CNP0257384.0
  • CAS Registry: 131-70-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
10-Nitrooleate

Formula: C18H33NO4
Exact Mass: 327.2409
Source ID: CNP0516796.0
  • CAS Registry: 88127-53-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Porphobilinogen

Formula: C10H14N2O4
Exact Mass: 226.0954
Source ID: CNP0307889.0
  • CAS Registry: 487-90-1
  • KEGG: C00931
  • LipidMAPS:
  • BioCYC: PORPHOBILINOGEN
Glycyrrhetinate

Formula: C30H46O4
Exact Mass: 470.3396
Source ID: CNP0264563.2
  • CAS Registry: 1449-05-4
  • KEGG: C02283
  • LipidMAPS: LMPR0106150014
  • BioCYC:
(-)-Sympatol

Formula: C9H13NO2
Exact Mass: 167.0946
Source ID: CNP0214406.1
  • CAS Registry: 614-35-7
  • KEGG: C01869
  • LipidMAPS:
  • BioCYC: 1-4-HYDROXYPHENYL-2-METHYLAMINOETHAN
1-Hexanol

Formula: C6H14O
Exact Mass: 102.1045
Source ID: CNP0317600.0
  • CAS Registry: 111-27-3
  • KEGG: C00854
  • LipidMAPS: LMFA05000117
  • BioCYC: HEXANOL-CMPD
Methyl ethyl ketone

Formula: C4H8O
Exact Mass: 72.0575
Source ID: CNP0486447.0
  • CAS Registry: 78-93-3
  • KEGG: C02845
  • LipidMAPS: LMFA12000043
  • BioCYC: MEK
4-Heptanone

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0310318.0
  • CAS Registry: 123-19-3
  • KEGG:
  • LipidMAPS: LMFA12000118
  • BioCYC:
Methyl propenyl ketone

Formula: C5H8O
Exact Mass: 84.0575
Source ID: CNP0158055.0
  • CAS Registry: 625-33-2
  • KEGG:
  • LipidMAPS: LMFA12000028
  • BioCYC:
3-Octen-2-one

Formula: C8H14O
Exact Mass: 126.1045
Source ID: CNP0125606.0
  • CAS Registry: 1669-44-9
  • KEGG:
  • LipidMAPS: LMFA12000009
  • BioCYC: CPD-13321
3-Cyano-L-alanine

Formula: C4H6N2O2
Exact Mass: 114.0429
Source ID: CNP0254991.1
  • CAS Registry: 6232-19-5
  • KEGG: C02512
  • LipidMAPS:
  • BioCYC: CPD-603
Cysteine

Formula: C3H7NO2S
Exact Mass: 121.0197
Source ID: CNP0280490.2
  • CAS Registry: 3374-22-9
  • KEGG: C00736
  • LipidMAPS:
  • BioCYC:
D-Glutamate

Formula: C5H9NO4
Exact Mass: 147.0532
Source ID: CNP0191057.2
  • CAS Registry: 6893-26-1
  • KEGG: C00217
  • LipidMAPS:
  • BioCYC: D-GLT
Diacetyl

Formula: C4H6O2
Exact Mass: 86.0368
Source ID: CNP0153215.0
  • CAS Registry: 431-03-8
  • KEGG: C00741
  • LipidMAPS: LMFA12000012
  • BioCYC: DIACETYL
GDP-D-mannose

Formula: C16H25N5O16P2
Exact Mass: 605.0772
Source ID: CNP0581335.1
  • CAS Registry: 3123-67-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Heptene

Formula: C7H14
Exact Mass: 98.1095
Source ID: CNP0158475.0
  • CAS Registry: 592-77-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,2,3,4,Tetrahydro-1,5,7-trimethylnapthalene

Formula: C13H18
Exact Mass: 174.1408
Source ID: CNP0186855.0
  • CAS Registry: 21693-55-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-hydroxyproline

Formula: C5H9NO3
Exact Mass: 131.0582
Source ID: CNP0368925.2
  • CAS Registry: 51-35-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
MG(18:1(9Z)/0:0/0:0)

Formula: C21H40O4
Exact Mass: 356.2926
Source ID: CNP0209532.1
  • CAS Registry: 129784-87-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
CIS-3-HEPTENE

Formula: C7H14
Exact Mass: 98.1095
Source ID: CNP0391454.0
  • CAS Registry: 14686-14-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
pinacol

Formula: C6H14O2
Exact Mass: 118.0994
Source ID: CNP0386051.0
  • CAS Registry: 76-09-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cycloocta-1,3-diene

Formula: C8H12
Exact Mass: 108.0939
Source ID: CNP0084968.0
  • CAS Registry: 1700-10-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
D-Galactono-1,4-lactone

Formula: C6H10O6
Exact Mass: 178.0477
Source ID: CNP0339002.1
  • CAS Registry: 2782-07-2
  • KEGG: C03383
  • LipidMAPS:
  • BioCYC: D-GALACTONO-1-4-LACTONE
9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-imino-3H-purin-6-ol

Formula: C10H13N5O4
Exact Mass: 267.0967
Source ID: CNP0605082.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(R)-2-Hydroxyglutarate

Formula: C5H8O5
Exact Mass: 148.0372
Source ID: CNP0156996.1
  • CAS Registry: 13095-47-1
  • KEGG: C01087
  • LipidMAPS:
  • BioCYC: R-2-HYDROXYGLUTARATE
Procaine

Formula: C13H20N2O2
Exact Mass: 236.1525
Source ID: CNP0316297.0
  • CAS Registry: 59-46-1
  • KEGG: C07375
  • LipidMAPS:
  • BioCYC:
5-Undecene

Formula: C11H22
Exact Mass: 154.1721
Source ID: CNP0245948.0
  • CAS Registry: 4941-53-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Butoxyethanol

Formula: C6H14O2
Exact Mass: 118.0994
Source ID: CNP0080154.0
  • CAS Registry: 111-76-2
  • KEGG: C19355
  • LipidMAPS:
  • BioCYC:
Isoxanthopterin

Formula: C6H5N5O2
Exact Mass: 179.0443
Source ID: CNP0503082.0
  • CAS Registry: 529-69-1
  • KEGG: C03975
  • LipidMAPS:
  • BioCYC: 2-AMINO-47-DIHYDROXYPTERIDINE
Xanthine

Formula: C5H4N4O2
Exact Mass: 152.0334
Source ID: CNP0484271.0
  • CAS Registry: 69-89-6
  • KEGG: C00385
  • LipidMAPS:
  • BioCYC: XANTHINE
Pentadecanol

Formula: C15H32O
Exact Mass: 228.2453
Source ID: CNP0150941.0
  • CAS Registry: 629-76-5
  • KEGG:
  • LipidMAPS: LMFA05000194
  • BioCYC: CPD-11595
2-Decanone

Formula: C10H20O
Exact Mass: 156.1514
Source ID: CNP0137224.0
  • CAS Registry: 693-54-9
  • KEGG:
  • LipidMAPS: LMFA12000044
  • BioCYC: CPD-18990
1-Decanol

Formula: C10H22O
Exact Mass: 158.1671
Source ID: CNP0305576.0
  • CAS Registry: 112-30-1
  • KEGG: C01633
  • LipidMAPS: LMFA05000062
  • BioCYC: CPD-17287
2-Octenal

Formula: C8H14O
Exact Mass: 126.1045
Source ID: CNP0192932.0
  • CAS Registry: 2363-89-5
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-13323
2-Methylbut-2-enedioic acid

Formula: C5H6O4
Exact Mass: 130.0266
Source ID: CNP0236669.0
  • CAS Registry: 7407-59-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Methylpentadecane

Formula: C16H34
Exact Mass: 226.266
Source ID: CNP0084820.0
  • CAS Registry: 2801-87-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cinnamaldehyde

Formula: C9H8O
Exact Mass: 132.0575
Source ID: CNP0279382.0
  • CAS Registry: 104-55-2
  • KEGG: C00903
  • LipidMAPS:
  • BioCYC: CINNAMALDEHYDE
Ethanolamine phosphate

Formula: C2H8NO4P
Exact Mass: 141.0191
Source ID: CNP0179004.0
  • CAS Registry: 1071-23-4
  • KEGG: C00346
  • LipidMAPS:
  • BioCYC: PHOSPHORYL-ETHANOLAMINE
2-Methylheptane

Formula: C8H18
Exact Mass: 114.1408
Source ID: CNP0146536.0
  • CAS Registry: 592-27-8
  • KEGG:
  • LipidMAPS: LMFA11000604
  • BioCYC:
1F-beta-D-Fructosylsucrose

Formula: C18H32O16
Exact Mass: 504.169
Source ID: CNP0207929.1
  • CAS Registry: 470-69-9
  • KEGG: C03661
  • LipidMAPS:
  • BioCYC: 1-KESTOTRIOSE
N,N-Dimethyl-5-methoxytryptamine

Formula: C13H18N2O
Exact Mass: 218.1419
Source ID: CNP0122681.0
  • CAS Registry: 1019-45-0
  • KEGG: C08309
  • LipidMAPS:
  • BioCYC:
L-Serine

Formula: C3H7NO3
Exact Mass: 105.0426
Source ID: CNP0275512.1
  • CAS Registry: 56-45-1
  • KEGG: C00065
  • LipidMAPS:
  • BioCYC: SER
Monomethyl glutaric acid

Formula: C6H10O4
Exact Mass: 146.0579
Source ID: CNP0216180.0
  • CAS Registry: 1501-27-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
9,12,13-TriHOME

Formula: C18H34O5
Exact Mass: 330.2406
Source ID: CNP0214896.1
  • CAS Registry: 97134-11-7
  • KEGG: C14833
  • LipidMAPS: LMFA02000014
  • BioCYC:
Calamenene

Formula: C15H22
Exact Mass: 202.1721
Source ID: CNP0275435.2
  • CAS Registry: 22339-23-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Oxohexane

Formula: C6H12O
Exact Mass: 100.0888
Source ID: CNP0194685.0
  • CAS Registry: 591-78-6
  • KEGG:
  • LipidMAPS: LMFA12000048
  • BioCYC: 2K-ADIPATE
Butyl butyrate

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0123594.0
  • CAS Registry: 109-21-7
  • KEGG:
  • LipidMAPS: LMFA07010418
  • BioCYC: CPD-19960
1-Butanol

Formula: C4H10O
Exact Mass: 74.0732
Source ID: CNP0505612.0
  • CAS Registry: 71-36-3
  • KEGG: C06142
  • LipidMAPS: LMFA05000109
  • BioCYC: BUTANOL
glucuronic acid

Formula: C6H10O7
Exact Mass: 194.0427
Source ID: CNP0171089.3
  • CAS Registry: 6556-12-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isoamyl butyrate

Formula: C9H18O2
Exact Mass: 158.1307
Source ID: CNP0144794.0
  • CAS Registry: 106-27-4
  • KEGG:
  • LipidMAPS: LMFA07010574
  • BioCYC:
Heptadecanoic acid

Formula: C17H34O2
Exact Mass: 270.2559
Source ID: CNP0215617.0
  • CAS Registry: 506-12-7
  • KEGG:
  • LipidMAPS: LMFA01010017
  • BioCYC: CPD-7830
(2S)-2-[[4-[[(6S)-5-formyl-4-hydroxy-2-imino-1,6,7,8-tetrahydropteridin-6-yl]methylamino]benzoyl]amino]pentanedioic acid

Formula: C20H23N7O7
Exact Mass: 473.1659
Source ID: CNP0567692.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isohexanol

Formula: C6H14O
Exact Mass: 102.1045
Source ID: CNP0344466.0
  • CAS Registry: 1320-98-5
  • KEGG:
  • LipidMAPS: LMFA05000541
  • BioCYC:
L-Allothreonine

Formula: C4H9NO3
Exact Mass: 119.0582
Source ID: CNP0361197.3
  • CAS Registry: 28954-12-3
  • KEGG: C05519
  • LipidMAPS:
  • BioCYC:
beta-Elemene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0176529.2
  • CAS Registry: 33880-83-0
  • KEGG: C17094
  • LipidMAPS:
  • BioCYC: CPD-8232
4,7-DIMETHYLBENZOFURAN

Formula: C10H10O
Exact Mass: 146.0732
Source ID: CNP0124753.0
  • CAS Registry: 28715-26-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
p-Menthan-3-ol

Formula: C10H20O
Exact Mass: 156.1514
Source ID: CNP0243697.1
  • CAS Registry: 1490-04-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Methyl 3-phenylpropanoate

Formula: C10H12O2
Exact Mass: 164.0837
Source ID: CNP0253198.0
  • CAS Registry: 103-25-3
  • KEGG:
  • LipidMAPS: LMFA07010951
  • BioCYC:
Cystine

Formula: C6H12N2O4S2
Exact Mass: 240.0238
Source ID: CNP0156303.1
  • CAS Registry: 923-32-0
  • KEGG: C01420
  • LipidMAPS:
  • BioCYC: cystine
(2R,3R,4S,5R)-2-(2-hydroxy-4-iminopyrimidin-1-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Formula: C9H13N3O5
Exact Mass: 243.0855
Source ID: CNP0482962.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
D-Galactarate

Formula: C6H10O8
Exact Mass: 210.0376
Source ID: CNP0223776.2
  • CAS Registry: 526-99-8
  • KEGG: C00879
  • LipidMAPS: LMFA01170107
  • BioCYC: D-GALACTARATE
(S)-(+)-alpha-Phellandrene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0162506.1
  • CAS Registry: 2243-33-6
  • KEGG: C11391
  • LipidMAPS:
  • BioCYC: CPD-18812
(S)-Malate

Formula: C4H6O5
Exact Mass: 134.0215
Source ID: CNP0152510.1
  • CAS Registry: 97-67-6
  • KEGG: C00149
  • LipidMAPS:
  • BioCYC: MAL
L-Arabitol

Formula: C5H12O5
Exact Mass: 152.0685
Source ID: CNP0264488.2
  • CAS Registry: 7643-75-6
  • KEGG: C00532
  • LipidMAPS:
  • BioCYC: L-ARABITOL
Docosane

Formula: C22H46
Exact Mass: 310.3599
Source ID: CNP0263508.0
  • CAS Registry: 629-97-0
  • KEGG:
  • LipidMAPS: LMFA11000569
  • BioCYC:
3-Hydroxyisovalerate

Formula: C5H10O3
Exact Mass: 118.063
Source ID: CNP0284455.0
  • CAS Registry: 625-08-1
  • KEGG: C20827
  • LipidMAPS: LMFA01050396
  • BioCYC:
GGYKPYDKXLHNTI-VAMGGRTRSA-N

Formula: C20H42
Exact Mass: 282.3286
Source ID: CNP0319004.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-hydroxy-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one

Formula: C9H12N2O5
Exact Mass: 228.0746
Source ID: CNP0592807.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-iminopyrimidin-2-ol

Formula: C9H13N3O4
Exact Mass: 227.0906
Source ID: CNP0546849.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Undecane

Formula: C11H24
Exact Mass: 156.1878
Source ID: CNP0270748.0
  • CAS Registry: 1120-21-4
  • KEGG:
  • LipidMAPS: LMFA11000591
  • BioCYC: CPD-9289
p-Mentha-1,3,8-triene

Formula: C10H14
Exact Mass: 134.1095
Source ID: CNP0154651.0
  • CAS Registry: 18368-95-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Hydroxypicolinic acid

Formula: C6H5NO3
Exact Mass: 139.0269
Source ID: CNP0251430.0
  • CAS Registry: 874-24-8
  • KEGG: C18620
  • LipidMAPS:
  • BioCYC:
6-Phenylundecane

Formula: C17H28
Exact Mass: 232.2191
Source ID: CNP0307648.0
  • CAS Registry: 4537-14-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Tridecanone

Formula: C13H26O
Exact Mass: 198.1984
Source ID: CNP0221288.0
  • CAS Registry: 593-08-8
  • KEGG:
  • LipidMAPS: LMFA12000058
  • BioCYC: CPD-7901
Isolimonene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0320205.1
  • CAS Registry: 499-99-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Tetradecanone

Formula: C14H28O
Exact Mass: 212.214
Source ID: CNP0420877.0
  • CAS Registry: 2345-27-9
  • KEGG:
  • LipidMAPS: LMFA12000177
  • BioCYC:
D-Aspartate

Formula: C4H7NO4
Exact Mass: 133.0375
Source ID: CNP0141839.2
  • CAS Registry: 1783-96-6
  • KEGG: C00402
  • LipidMAPS:
  • BioCYC: CPD-302
Alanine

Formula: C3H7NO2
Exact Mass: 89.0477
Source ID: CNP0313085.2
  • CAS Registry: 302-72-7
  • KEGG: C01401
  • LipidMAPS:
  • BioCYC: L-ALPHA-ALANINE
Dehydroabietic acid

Formula: C20H28O2
Exact Mass: 300.2089
Source ID: CNP0192451.2
  • CAS Registry: 1740-19-8
  • KEGG: C12078
  • LipidMAPS: LMPR0104050005
  • BioCYC: CPD-8725
Isoxanthopterin

Formula: C5H5N5O
Exact Mass: 151.0494
Source ID: CNP0517372.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Methyl butyrate

Formula: C5H10O2
Exact Mass: 102.0681
Source ID: CNP0159910.0
  • CAS Registry: 623-42-7
  • KEGG:
  • LipidMAPS: LMFA07010528
  • BioCYC:
2,3-Dihydrobenzofuran

Formula: C8H8O
Exact Mass: 120.0575
Source ID: CNP0256577.0
  • CAS Registry: 496-16-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(13E)-(15S)-15-Hydroxy-9-oxoprosta-10,13-dienoate

Formula: C20H32O4
Exact Mass: 336.23
Source ID: CNP0177052.2
  • CAS Registry: 14152-28-4
  • KEGG: C04685
  • LipidMAPS: LMFA03010005
  • BioCYC:
Dichloromethane

Formula: CH2Cl2
Exact Mass: 83.9534
Source ID: CNP0529345.0
  • CAS Registry: 75-09-2
  • KEGG: C02271
  • LipidMAPS:
  • BioCYC: CPD-681
N-Decane

Formula: C10H22
Exact Mass: 142.1721
Source ID: CNP0279708.0
  • CAS Registry: 124-18-5
  • KEGG:
  • LipidMAPS: LMFA11000568
  • BioCYC: CPD-9287
(E)-2-Penten-1-ol

Formula: C5H10O
Exact Mass: 86.0732
Source ID: CNP0239009.0
  • CAS Registry: 1576-96-1
  • KEGG:
  • LipidMAPS: LMFA05000110
  • BioCYC: CPD-13229
beta-Citronellol

Formula: C10H20O
Exact Mass: 156.1514
Source ID: CNP0152105.1
  • CAS Registry: 106-22-9
  • KEGG: C09849
  • LipidMAPS: LMPR0102010008
  • BioCYC: CPD-12877
1-Tridecanol

Formula: C13H28O
Exact Mass: 200.214
Source ID: CNP0139347.0
  • CAS Registry: 112-70-9
  • KEGG: C14509
  • LipidMAPS: LMFA05000171
  • BioCYC:
2-dodecene

Formula: C12H24
Exact Mass: 168.1878
Source ID: CNP0084835.0
  • CAS Registry: 1652-96-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
yunaconitine

Formula: C35H49NO11
Exact Mass: 659.3305
Source ID: CNP0303418.3
  • CAS Registry: 70578-24-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
glyceric acid

Formula: C3H6O4
Exact Mass: 106.0266
Source ID: CNP0264905.1
  • CAS Registry: 473-81-4
  • KEGG: C00258
  • LipidMAPS:
  • BioCYC:
Dimethyl sulfone

Formula: C2H6O2S
Exact Mass: 94.0088
Source ID: CNP0605129.0
  • CAS Registry: 67-71-0
  • KEGG: C11142
  • LipidMAPS:
  • BioCYC: CPD-10437
3-(Methylthio)propanal

Formula: C4H8OS
Exact Mass: 104.0296
Source ID: CNP0136743.0
  • CAS Registry: 3268-49-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pyridoxine phosphate

Formula: C8H12NO6P
Exact Mass: 249.0402
Source ID: CNP0348406.0
  • CAS Registry: 447-05-2
  • KEGG: C00627
  • LipidMAPS:
  • BioCYC:
2-Naphthol

Formula: C10H8O
Exact Mass: 144.0575
Source ID: CNP0320773.0
  • CAS Registry: 135-19-3
  • KEGG: C11713
  • LipidMAPS:
  • BioCYC: CPD-8131
Solanidine

Formula: C27H43NO
Exact Mass: 397.3344
Source ID: CNP0267644.2
  • CAS Registry: 80-78-4
  • KEGG: C06543
  • LipidMAPS: LMST01150007
  • BioCYC:
Nonanal

Formula: C9H18O
Exact Mass: 142.1358
Source ID: CNP0328165.0
  • CAS Registry: 124-19-6
  • KEGG:
  • LipidMAPS: LMFA06000040
  • BioCYC: CPD-8491
4-Methylpentanal

Formula: C6H12O
Exact Mass: 100.0888
Source ID: CNP0304790.0
  • CAS Registry: 1119-16-0
  • KEGG: C02373
  • LipidMAPS: LMFA06000109
  • BioCYC: HEXANAL
3-(Methylthio)-1-propanol

Formula: C4H10OS
Exact Mass: 106.0452
Source ID: CNP0359993.0
  • CAS Registry: 505-10-2
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-7037
Alloocimene I

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0248120.0
  • CAS Registry: 673-84-7
  • KEGG:
  • LipidMAPS: LMFA11000042
  • BioCYC:
D-Glutamine

Formula: C5H10N2O3
Exact Mass: 146.0691
Source ID: CNP0361973.2
  • CAS Registry: 5959-95-5
  • KEGG: C00819
  • LipidMAPS:
  • BioCYC: GLUTAMIDE
Stachydrine

Formula: C7H13NO2
Exact Mass: 143.0946
Source ID: CNP0596963.1
  • CAS Registry: 471-87-4
  • KEGG: C10172
  • LipidMAPS:
  • BioCYC: CPD-821
Crenulatin

Formula: C11H20O6
Exact Mass: 248.126
Source ID: CNP0130797.1
  • CAS Registry: 63026-02-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
D-Serine

Formula: C3H7NO3
Exact Mass: 105.0426
Source ID: CNP0275512.2
  • CAS Registry: 312-84-5
  • KEGG: C00740
  • LipidMAPS:
  • BioCYC: D-SERINE
Urocanate

Formula: C6H6N2O2
Exact Mass: 138.0429
Source ID: CNP0254048.0
  • CAS Registry: 104-98-3
  • KEGG: C00785
  • LipidMAPS:
  • BioCYC: UROCANATE
1,4-Dichlorobenzene

Formula: C6H4Cl2
Exact Mass: 145.969
Source ID: CNP0341270.0
  • CAS Registry: 106-46-7
  • KEGG: C07092
  • LipidMAPS:
  • BioCYC: 14-DICHLOROBENZENE
[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(4-hydroxy-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate

Formula: C15H24N2O17P2
Exact Mass: 566.055
Source ID: CNP0602545.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
16b-Hydroxyestradiol

Formula: C18H24O3
Exact Mass: 288.1725
Source ID: CNP0216041.3
  • CAS Registry: 547-81-9
  • KEGG:
  • LipidMAPS: LMST02010006
  • BioCYC:
Eicosane

Formula: C20H42
Exact Mass: 282.3286
Source ID: CNP0228467.0
  • CAS Registry: 112-95-8
  • KEGG:
  • LipidMAPS: LMFA11000571
  • BioCYC: CPD-14231
Nonadienal

Formula: C9H14O
Exact Mass: 138.1045
Source ID: CNP0175411.0
  • CAS Registry: 30551-17-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
alpha-Oxo-benzeneacetic acid

Formula: C8H6O3
Exact Mass: 150.0317
Source ID: CNP0256089.0
  • CAS Registry: 611-73-4
  • KEGG: C02137
  • LipidMAPS:
  • BioCYC: PHENYLGLYOXYLATE
Methyl isothiocyanate

Formula: C2H3NS
Exact Mass: 72.9986
Source ID: CNP0601890.0
  • CAS Registry: 556-61-6
  • KEGG: C18587
  • LipidMAPS:
  • BioCYC:
Adenine

Formula: C5H5N5
Exact Mass: 135.0545
Source ID: CNP0479821.0
  • CAS Registry: 73-24-5
  • KEGG: C00147
  • LipidMAPS:
  • BioCYC: ADENINE
gamma-Terpineol

Formula: C10H18O
Exact Mass: 154.1358
Source ID: CNP0325336.0
  • CAS Registry: 586-81-2
  • KEGG: C17518
  • LipidMAPS:
  • BioCYC:
9-[(4aR,6R,7R,7aS)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-imino-3H-purin-6-ol

Formula: C10H12N5O7P
Exact Mass: 345.0474
Source ID: CNP0493601.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Nonenal

Formula: C9H16O
Exact Mass: 140.1201
Source ID: CNP0163216.0
  • CAS Registry: 2463-53-8
  • KEGG:
  • LipidMAPS: LMFA06000041
  • BioCYC: T-2-NONENAL-CMPD
Octa-1,3-diene

Formula: C8H14
Exact Mass: 110.1095
Source ID: CNP0084214.0
  • CAS Registry: 1002-33-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
FSL0569

Formula: C19H19N7O6
Exact Mass: 441.1397
Source ID: CNP0528342.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Pentylthiophene

Formula: C9H14S
Exact Mass: 154.0816
Source ID: CNP0094840.0
  • CAS Registry: 4861-58-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Methyl hexanoate

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0192346.0
  • CAS Registry: 106-70-7
  • KEGG:
  • LipidMAPS: LMFA07010433
  • BioCYC:
Propylbenzene

Formula: C9H12
Exact Mass: 120.0939
Source ID: CNP0279045.0
  • CAS Registry: 103-65-1
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-20037
3,7,11-trimethyldodecan-1-ol

Formula: C15H32O
Exact Mass: 228.2453
Source ID: CNP0083057.0
  • CAS Registry: 6750-34-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Metformin

Formula: C4H11N5
Exact Mass: 129.1014
Source ID: CNP0499713.0
  • CAS Registry: 657-24-9
  • KEGG: C07151
  • LipidMAPS:
  • BioCYC:
Aspirin

Formula: C9H8O4
Exact Mass: 180.0423
Source ID: CNP0300507.0
  • CAS Registry: 50-78-2
  • KEGG: C01405
  • LipidMAPS:
  • BioCYC: CPD-524
1-Methylpyrrole

Formula: C5H7N
Exact Mass: 81.0578
Source ID: CNP0084622.0
  • CAS Registry: 96-54-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
FSL0952

Formula: C10H12N4O6
Exact Mass: 284.0757
Source ID: CNP0600691.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Indane

Formula: C9H10
Exact Mass: 118.0782
Source ID: CNP0252618.0
  • CAS Registry: 496-11-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
6-hydroxy-3-methyl-9H-purin-2-one

Formula: C6H6N4O2
Exact Mass: 166.0491
Source ID: CNP0581679.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Formylanthranilate

Formula: C8H7NO3
Exact Mass: 165.0426
Source ID: CNP0131461.0
  • CAS Registry: 3342-77-6
  • KEGG: C05653
  • LipidMAPS:
  • BioCYC:
5-[(3aR,6S,6aS)-2-hydroxy-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-6-yl]pentanoic acid

Formula: C10H16N2O3S
Exact Mass: 244.0882
Source ID: CNP0605689.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-hydroxy-5-methylpyrimidin-2-one

Formula: C10H14N2O6
Exact Mass: 258.0852
Source ID: CNP0560021.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cytosine

Formula: C4H5N3O
Exact Mass: 111.0433
Source ID: CNP0571963.0
  • CAS Registry: 71-30-7
  • KEGG: C00380
  • LipidMAPS:
  • BioCYC: CYTOSINE
2,6-dimethyl-1,3,5,7-octatetraene

Formula: C10H14
Exact Mass: 134.1095
Source ID: CNP0243185.0
  • CAS Registry: 90973-78-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
L-Pipecolate

Formula: C6H11NO2
Exact Mass: 129.079
Source ID: CNP0148927.2
  • CAS Registry: 3105-95-1
  • KEGG: C00408
  • LipidMAPS:
  • BioCYC: L-PIPECOLATE
Tetradecanol

Formula: C14H30O
Exact Mass: 214.2297
Source ID: CNP0209818.0
  • CAS Registry: 112-72-1
  • KEGG:
  • LipidMAPS: LMFA05000041
  • BioCYC: CPD-7875
Heptadecanoyl carnitine

Formula: C24H47NO4
Exact Mass: 413.3505
Source ID: CNP0518658.0
  • CAS Registry: 106182-29-0
  • KEGG:
  • LipidMAPS: LMFA07070067
  • BioCYC:
2-Ethyl-2-hexenal

Formula: C8H14O
Exact Mass: 126.1045
Source ID: CNP0088815.0
  • CAS Registry: 645-62-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,1,2-Trimethyl-3,5-bis(1-methylethenyl)cyclohexane

Formula: C15H26
Exact Mass: 206.2034
Source ID: CNP0083996.0
  • CAS Registry: 610770-63-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Decanal

Formula: C10H20O
Exact Mass: 156.1514
Source ID: CNP0263174.0
  • CAS Registry: 112-31-2
  • KEGG: C12307
  • LipidMAPS: LMFA06000052
  • BioCYC: CPD-8490
Ethyl butyrate

Formula: C6H12O2
Exact Mass: 116.0837
Source ID: CNP0232050.0
  • CAS Registry: 105-54-4
  • KEGG:
  • LipidMAPS: LMFA07010874
  • BioCYC: CPD-22381
1-Hexadecanol

Formula: C16H34O
Exact Mass: 242.261
Source ID: CNP0187598.0
  • CAS Registry: 36653-82-4
  • KEGG: C00823
  • LipidMAPS: LMFA05000061
  • BioCYC: CPD-348
Pulegone

Formula: C10H16O
Exact Mass: 152.1201
Source ID: CNP0270635.1
  • CAS Registry: 89-82-7
  • KEGG: C09893
  • LipidMAPS: LMPR0102090025
  • BioCYC: CPD-4942
Nonadecanoic acid

Formula: C19H38O2
Exact Mass: 298.2872
Source ID: CNP0364249.0
  • CAS Registry: 646-30-0
  • KEGG: C16535
  • LipidMAPS: LMFA01010019
  • BioCYC:
gamma-Nonalactone

Formula: C9H16O2
Exact Mass: 156.115
Source ID: CNP0388431.1
  • CAS Registry: 104-61-0
  • KEGG: C08501
  • LipidMAPS: LMFA07040021
  • BioCYC:
Methylcyclopentane

Formula: C6H12
Exact Mass: 84.0939
Source ID: CNP0194612.0
  • CAS Registry: 96-37-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(S)-2-Methylbutanoic acid

Formula: C5H10O2
Exact Mass: 102.0681
Source ID: CNP0187792.2
  • CAS Registry: 1730-91-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Hydroxyindole

Formula: C8H7NO
Exact Mass: 133.0528
Source ID: CNP0421176.0
  • CAS Registry: 1953-54-4
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-16174
Turanose

Formula: C12H22O11
Exact Mass: 342.1162
Source ID: CNP0346928.1
  • CAS Registry: 547-25-1
  • KEGG: C19636
  • LipidMAPS:
  • BioCYC: CPD-13399
myo-Inositol

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0254016.4
  • CAS Registry: 87-89-8
  • KEGG: C00137
  • LipidMAPS:
  • BioCYC: MYO-INOSITOL
1-(Methylthio)-propane

Formula: C4H10S
Exact Mass: 90.0503
Source ID: CNP0481317.0
  • CAS Registry: 3877-15-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Hydroxyproline

Formula: C5H9NO3
Exact Mass: 131.0582
Source ID: CNP0193079.1
  • CAS Registry: 567-36-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
L-Cysteate

Formula: C3H7NO5S
Exact Mass: 169.0045
Source ID: CNP0171540.1
  • CAS Registry: 13100-82-8
  • KEGG: C00506
  • LipidMAPS:
  • BioCYC: L-CYSTEATE
Methyl isobutyl ketone

Formula: C6H12O
Exact Mass: 100.0888
Source ID: CNP0178924.0
  • CAS Registry: 108-10-1
  • KEGG: C19263
  • LipidMAPS: LMFA12000033
  • BioCYC:
Menadione

Formula: C11H8O2
Exact Mass: 172.0524
Source ID: CNP0289736.0
  • CAS Registry: 58-27-5
  • KEGG: C05377
  • LipidMAPS:
  • BioCYC: CPD-3766
2,5-Dimethyl-2,4-hexadiene

Formula: C8H14
Exact Mass: 110.1095
Source ID: CNP0084726.0
  • CAS Registry: 764-13-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Desmosterol

Formula: C27H44O
Exact Mass: 384.3392
Source ID: CNP0236491.2
  • CAS Registry: 313-04-2
  • KEGG: C01802
  • LipidMAPS: LMST01010016
  • BioCYC: DESMOSTEROL-CPD
Bisphenol A

Formula: C15H16O2
Exact Mass: 228.115
Source ID: CNP0314755.0
  • CAS Registry: 80-05-7
  • KEGG: C13624
  • LipidMAPS:
  • BioCYC: CPD-18833
Ephedrine

Formula: C10H15NO
Exact Mass: 165.1154
Source ID: CNP0171581.4
  • CAS Registry: 299-42-3
  • KEGG: C01575
  • LipidMAPS:
  • BioCYC:
4-Methoxyphenylacetic acid

Formula: C9H10O3
Exact Mass: 166.063
Source ID: CNP0125359.0
  • CAS Registry: 104-01-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Iminodiacetate

Formula: C4H7NO4
Exact Mass: 133.0375
Source ID: CNP0080016.0
  • CAS Registry: 142-73-4
  • KEGG: C19911
  • LipidMAPS:
  • BioCYC: CPD-10189
L-Glyceric acid

Formula: C3H6O4
Exact Mass: 106.0266
Source ID: CNP0264905.2
  • CAS Registry: 28305-26-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,3-Hexanedione

Formula: C6H10O2
Exact Mass: 114.0681
Source ID: CNP0318298.0
  • CAS Registry: 3848-24-6
  • KEGG:
  • LipidMAPS: LMFA12000247
  • BioCYC: CPD-9081
9(S)-HODE

Formula: C18H32O3
Exact Mass: 296.2351
Source ID: CNP0206712.2
  • CAS Registry: 73543-67-6
  • KEGG: C14767
  • LipidMAPS: LMFA02000036
  • BioCYC:
Isomaltose

Formula: C12H22O11
Exact Mass: 342.1162
Source ID: CNP0212546.8
  • CAS Registry: 499-40-1
  • KEGG: C00252
  • LipidMAPS:
  • BioCYC: Isomaltose
3-Methyl-2-oxobutanoic acid

Formula: C5H8O3
Exact Mass: 116.0473
Source ID: CNP0207859.0
  • CAS Registry: 759-05-7
  • KEGG: C00141
  • LipidMAPS: LMFA01020274
  • BioCYC: 2-KETO-ISOVALERATE
Nicotine

Formula: C10H14N2
Exact Mass: 162.1157
Source ID: CNP0218587.1
  • CAS Registry: 54-11-5
  • KEGG: C00745
  • LipidMAPS:
  • BioCYC: NICOTINE
Hexadecanal

Formula: C16H32O
Exact Mass: 240.2453
Source ID: CNP0198736.0
  • CAS Registry: 629-80-1
  • KEGG: C00517
  • LipidMAPS: LMFA06000088
  • BioCYC: PALMITALDEHYDE
Octacosane

Formula: C28H58
Exact Mass: 394.4538
Source ID: CNP0298040.0
  • CAS Registry: 630-02-4
  • KEGG:
  • LipidMAPS: LMFA11000580
  • BioCYC: CPD-9765
Tetradecanal

Formula: C14H28O
Exact Mass: 212.214
Source ID: CNP0200880.0
  • CAS Registry: 124-25-4
  • KEGG:
  • LipidMAPS: LMFA06000078
  • BioCYC: CPD-7886
Pentadecanal

Formula: C15H30O
Exact Mass: 226.2297
Source ID: CNP0331942.0
  • CAS Registry: 2765-11-9
  • KEGG: C01948
  • LipidMAPS: LMFA06000083
  • BioCYC: CPD-388
N-Methylserotonin

Formula: C11H14N2O
Exact Mass: 190.1106
Source ID: CNP0367300.0
  • CAS Registry: 1134-01-6
  • KEGG: C06212
  • LipidMAPS:
  • BioCYC:
Butyl propionate

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0139208.0
  • CAS Registry: 590-01-2
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-19956
2-methyltridecane

Formula: C14H30
Exact Mass: 198.2347
Source ID: CNP0149200.0
  • CAS Registry: 1560-96-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Phenyl-1-propanol

Formula: C9H12O
Exact Mass: 136.0888
Source ID: CNP0393684.0
  • CAS Registry: 122-97-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Heptadecane

Formula: C17H36
Exact Mass: 240.2817
Source ID: CNP0342809.0
  • CAS Registry: 629-78-7
  • KEGG: C01816
  • LipidMAPS: LMFA11000003
  • BioCYC: HEPTADECANE-CPD
arabinitol

Formula: C5H12O5
Exact Mass: 152.0685
Source ID: CNP0264488.3
  • CAS Registry: 488-82-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Diisobutyl phthalate

Formula: C16H22O4
Exact Mass: 278.1518
Source ID: CNP0124414.0
  • CAS Registry: 84-69-5
  • KEGG: C15205
  • LipidMAPS:
  • BioCYC:
24,25-Dihydroxyvitamin D

Formula: C27H44O3
Exact Mass: 416.329
Source ID: CNP0343062.2
  • CAS Registry: 40013-87-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
gamma-Tocopherol

Formula: C28H48O2
Exact Mass: 416.3654
Source ID: CNP0145131.2
  • CAS Registry: 54-28-4
  • KEGG: C02483
  • LipidMAPS: LMPR02020065
  • BioCYC: GAMA-TOCOPHEROL
Tricosanoic acid

Formula: C23H46O2
Exact Mass: 354.3498
Source ID: CNP0216314.0
  • CAS Registry: 2433-96-7
  • KEGG:
  • LipidMAPS: LMFA01010023
  • BioCYC: CPD-7834
Toluate

Formula: C8H8O2
Exact Mass: 136.0524
Source ID: CNP0232170.0
  • CAS Registry: 99-94-5
  • KEGG: C01454
  • LipidMAPS:
  • BioCYC:
Octyl butanoate

Formula: C12H24O2
Exact Mass: 200.1776
Source ID: CNP0140143.0
  • CAS Registry: 110-39-4
  • KEGG:
  • LipidMAPS: LMFA07010420
  • BioCYC:
Cyanidin 3-O-glucoside

Formula: C21H21O11
Exact Mass: 449.1084
Source ID: CNP0583867.3
  • CAS Registry: 7084-24-4
  • KEGG: C08604
  • LipidMAPS: LMPK12010110
  • BioCYC:
2-Acetylfuran

Formula: C6H6O2
Exact Mass: 110.0368
Source ID: CNP0350272.0
  • CAS Registry: 1192-62-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pentadecane

Formula: C15H32
Exact Mass: 212.2504
Source ID: CNP0314547.0
  • CAS Registry: 629-62-9
  • KEGG: C08388
  • LipidMAPS: LMFA11000006
  • BioCYC: CPD-7946
Myrcene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0241365.0
  • CAS Registry: 123-35-3
  • KEGG: C06074
  • LipidMAPS: LMPR0102010005
  • BioCYC: CPD-4888
Stigmasterol

Formula: C29H48O
Exact Mass: 412.3705
Source ID: CNP0389131.15
  • CAS Registry: 83-48-7
  • KEGG: C05442
  • LipidMAPS: LMST01040123
  • BioCYC: CPD-4162
(S)-Limonene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0282017.1
  • CAS Registry: 5989-54-8
  • KEGG: C00521
  • LipidMAPS: LMPR0102090013
  • BioCYC: CPD-4886
2-Dodecanone

Formula: C12H24O
Exact Mass: 184.1827
Source ID: CNP0168691.0
  • CAS Registry: 6175-49-1
  • KEGG: C14996
  • LipidMAPS: LMFA12000163
  • BioCYC:
p-Xylene

Formula: C8H10
Exact Mass: 106.0782
Source ID: CNP0227482.0
  • CAS Registry: 106-42-3
  • KEGG: C06756
  • LipidMAPS:
  • BioCYC: CPD-1422
Putrescine

Formula: C4H12N2
Exact Mass: 88.1
Source ID: CNP0116270.0
  • CAS Registry: 110-60-1
  • KEGG: C00134
  • LipidMAPS:
  • BioCYC: PUTRESCINE
Naphthalene

Formula: C10H8
Exact Mass: 128.0626
Source ID: CNP0256712.0
  • CAS Registry: 91-20-3
  • KEGG: C00829
  • LipidMAPS:
  • BioCYC: NAPHTHALENE
2-Heptanone

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0240774.0
  • CAS Registry: 110-43-0
  • KEGG: C08380
  • LipidMAPS: LMFA12000004
  • BioCYC:
Hexanoic acid

Formula: C6H12O2
Exact Mass: 116.0837
Source ID: CNP0210437.0
  • CAS Registry: 142-62-1
  • KEGG: C01585
  • LipidMAPS: LMFA01010006
  • BioCYC: HEXANOATE
2-Methylpropanoate

Formula: C4H8O2
Exact Mass: 88.0524
Source ID: CNP0197560.0
  • CAS Registry: 79-31-2
  • KEGG: C02632
  • LipidMAPS: LMFA01020071
  • BioCYC: ISOBUTYRATE
p-Hydroxybenzyl alcohol

Formula: C7H8O2
Exact Mass: 124.0524
Source ID: CNP0103281.0
  • CAS Registry: 623-05-2
  • KEGG: C17467
  • LipidMAPS:
  • BioCYC: 4-HYDROXY-BENZYL-ALCOHOL
Tetradecane

Formula: C14H30
Exact Mass: 198.2347
Source ID: CNP0293304.0
  • CAS Registry: 629-59-4
  • KEGG:
  • LipidMAPS: LMFA11000586
  • BioCYC:
Nonanoic acid

Formula: C9H18O2
Exact Mass: 158.1307
Source ID: CNP0128686.0
  • CAS Registry: 112-05-0
  • KEGG: C01601
  • LipidMAPS: LMFA01010009
  • BioCYC: CPD-8505
Nonane

Formula: C9H20
Exact Mass: 128.1565
Source ID: CNP0402619.0
  • CAS Registry: 111-84-2
  • KEGG: C02445
  • LipidMAPS: LMFA11000579
  • BioCYC: CPD-9284
Jasmone

Formula: C11H16O
Exact Mass: 164.1201
Source ID: CNP0206003.0
  • CAS Registry: 488-10-8
  • KEGG: C08490
  • LipidMAPS: LMFA02020009
  • BioCYC:
Hydroquinone

Formula: C6H6O2
Exact Mass: 110.0368
Source ID: CNP0246516.0
  • CAS Registry: 123-31-9
  • KEGG: C00530
  • LipidMAPS:
  • BioCYC: HYDROQUINONE
3,4-Dihydroxy-L-phenylalanine

Formula: C9H11NO4
Exact Mass: 197.0688
Source ID: CNP0290328.1
  • CAS Registry: 59-92-7
  • KEGG: C00355
  • LipidMAPS:
  • BioCYC: L-DIHYDROXY-PHENYLALANINE
Styrene

Formula: C8H8
Exact Mass: 104.0626
Source ID: CNP0111430.0
  • CAS Registry: 100-42-5
  • KEGG: C07083
  • LipidMAPS:
  • BioCYC: CPD-1092
Theophylline

Formula: C7H8N4O2
Exact Mass: 180.0647
Source ID: CNP0334081.0
  • CAS Registry: 58-55-9
  • KEGG: C07130
  • LipidMAPS:
  • BioCYC: CPD-12479
Crotonaldehyde

Formula: C4H6O
Exact Mass: 70.0419
Source ID: CNP0576575.0
  • CAS Registry: 4170-30-3
  • KEGG: C19377
  • LipidMAPS:
  • BioCYC: CPD-23505
Acrolein

Formula: C3H4O
Exact Mass: 56.0262
Source ID: CNP0603221.0
  • CAS Registry: 107-02-8
  • KEGG: C01471
  • LipidMAPS:
  • BioCYC: ACROLEIN
Melezitose

Formula: C18H32O16
Exact Mass: 504.169
Source ID: CNP0198142.1
  • CAS Registry: 597-12-6
  • KEGG: C08243
  • LipidMAPS:
  • BioCYC: CPD-13409
m-Chlorobenzoic acid

Formula: C7H5ClO2
Exact Mass: 155.9978
Source ID: CNP0206363.0
  • CAS Registry: 535-80-8
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-3486
2,3,4,5-tetrahydropyridin-6-ol

Formula: C5H9NO
Exact Mass: 99.0684
Source ID: CNP0547052.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Fluoren-9-ol

Formula: C13H10O
Exact Mass: 182.0732
Source ID: CNP0082925.0
  • CAS Registry: 1689-64-1
  • KEGG: C06711
  • LipidMAPS:
  • BioCYC: 9FLUORENOL
1,3-Dithiane

Formula: C4H8S2
Exact Mass: 120.0067
Source ID: CNP0221424.0
  • CAS Registry: 505-23-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Anisole

Formula: C7H8O
Exact Mass: 108.0575
Source ID: CNP0226394.0
  • CAS Registry: 100-66-3
  • KEGG: C01403
  • LipidMAPS:
  • BioCYC: CPD-395
Sarcosine

Formula: C3H7NO2
Exact Mass: 89.0477
Source ID: CNP0307073.0
  • CAS Registry: 107-97-1
  • KEGG: C00213
  • LipidMAPS:
  • BioCYC: SARCOSINE
Pentyl 3-methylbutanoate

Formula: C10H20O2
Exact Mass: 172.1463
Source ID: CNP0135492.0
  • CAS Registry: 25415-62-7
  • KEGG:
  • LipidMAPS: LMFA07010988
  • BioCYC:
1-Phenyl-1-propanone

Formula: C9H10O
Exact Mass: 134.0732
Source ID: CNP0320895.0
  • CAS Registry: 93-55-0
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-23551
Tiglic aldehyde

Formula: C5H8O
Exact Mass: 84.0575
Source ID: CNP0281160.0
  • CAS Registry: 497-03-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2E)-2-Heptenal

Formula: C7H12O
Exact Mass: 112.0888
Source ID: CNP0210810.0
  • CAS Registry: 2463-63-0
  • KEGG:
  • LipidMAPS: LMFA06000019
  • BioCYC:
2-Methyl-2-pentenal

Formula: C6H10O
Exact Mass: 98.0732
Source ID: CNP0245615.0
  • CAS Registry: 623-36-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-[(2Z)-2-[[3-(2-carboxyethyl)-5-[[(2S)-3-ethyl-5-hydroxy-4-methyl-2H-pyrrol-2-yl]methyl]-4-methyl-1H-pyrrol-2-yl]methylidene]-5-[[(2S)-4-ethyl-5-hydroxy-3-methyl-2H-pyrrol-2-yl]methyl]-4-methylpyrrol-3-yl]propanoic acid

Formula: C33H42N4O6
Exact Mass: 590.3104
Source ID: CNP0519606.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
pseudobrucine

Formula: C23H26N2O5
Exact Mass: 410.1842
Source ID: CNP0248985.1
  • CAS Registry: 560-30-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
foresaconitine

Formula: C35H49NO9
Exact Mass: 627.3407
Source ID: CNP0234377.2
  • CAS Registry: 73870-35-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-[3-[(6-imino-2-methyl-1H-pyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl phosphono hydrogen phosphate

Formula: [C12H19N4O7P2S]+
Exact Mass: 425.045
Source ID: CNP0584884.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
6-Methyl-3,5-heptadien-2-one

Formula: C8H12O
Exact Mass: 124.0888
Source ID: CNP0275973.0
  • CAS Registry: 1604-28-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3,8-dimethylundecane

Formula: C13H28
Exact Mass: 184.2191
Source ID: CNP0282190.0
  • CAS Registry: 17301-30-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-hydroxy-3-methyl-4H-imidazol-2-one

Formula: C4H6N2O2
Exact Mass: 114.0429
Source ID: CNP0592460.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Histamine

Formula: C5H9N3
Exact Mass: 111.0796
Source ID: CNP0591741.0
  • CAS Registry: 51-45-6
  • KEGG: C00388
  • LipidMAPS:
  • BioCYC: HISTAMINE
1,3-Dihydroxypropan-2-yl oleate

Formula: C21H40O4
Exact Mass: 356.2926
Source ID: CNP0217735.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Agmatine

Formula: C5H14N4
Exact Mass: 130.1218
Source ID: CNP0572375.0
  • CAS Registry: 306-60-5
  • KEGG: C00179
  • LipidMAPS:
  • BioCYC:
Butyl acetate

Formula: C6H12O2
Exact Mass: 116.0837
Source ID: CNP0158571.0
  • CAS Registry: 123-86-4
  • KEGG: C12304
  • LipidMAPS:
  • BioCYC: CPD-13346
Acetylcysteine

Formula: C5H9NO3S
Exact Mass: 163.0303
Source ID: CNP0541980.2
  • CAS Registry: 616-91-1
  • KEGG: C06809
  • LipidMAPS:
  • BioCYC: CPD-9175
Acrylic acid

Formula: C3H4O2
Exact Mass: 72.0211
Source ID: CNP0590547.0
  • CAS Registry: 79-10-7
  • KEGG: C00511
  • LipidMAPS: LMFA01030193
  • BioCYC: MY148411
D-Threitol

Formula: C4H10O4
Exact Mass: 122.0579
Source ID: CNP0150660.2
  • CAS Registry: 2418-52-2
  • KEGG: C16884
  • LipidMAPS:
  • BioCYC: CPD-12825
(-)-alpha-Pinene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0203449.2
  • CAS Registry: 7785-26-4
  • KEGG: C06308
  • LipidMAPS:
  • BioCYC: CPD-4892
1,8-Cineole

Formula: C10H18O
Exact Mass: 154.1358
Source ID: CNP0160255.1
  • CAS Registry: 470-82-6
  • KEGG: C09844
  • LipidMAPS: LMPR0102090019
  • BioCYC: CPD-4261
897-55-2

Formula: C19H18N2
Exact Mass: 274.147
Source ID: CNP0079944.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Penten-3-one

Formula: C5H8O
Exact Mass: 84.0575
Source ID: CNP0362181.0
  • CAS Registry: 1629-58-9
  • KEGG:
  • LipidMAPS: LMFA12000069
  • BioCYC: CPD-13218
Phenylpyruvate

Formula: C9H8O3
Exact Mass: 164.0473
Source ID: CNP0177093.0
  • CAS Registry: 156-06-9
  • KEGG: C00166
  • LipidMAPS:
  • BioCYC:
alpha-Tocotrienol

Formula: C29H44O2
Exact Mass: 424.3341
Source ID: CNP0178257.1
  • CAS Registry: 1721-51-3
  • KEGG: C14153
  • LipidMAPS: LMPR02020054
  • BioCYC: CPD-15836
Hexyl butyrate

Formula: C10H20O2
Exact Mass: 172.1463
Source ID: CNP0153531.0
  • CAS Registry: 2639-63-6
  • KEGG:
  • LipidMAPS: LMFA07010419
  • BioCYC: CPD-22638
2-Phenyl-2-butenal

Formula: C10H10O
Exact Mass: 146.0732
Source ID: CNP0164159.0
  • CAS Registry: 4411-89-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
L-Homoserine

Formula: C4H9NO3
Exact Mass: 119.0582
Source ID: CNP0287745.2
  • CAS Registry: 672-15-1
  • KEGG: C00263
  • LipidMAPS:
  • BioCYC: HOMO-SER
Aconine

Formula: C25H41NO9
Exact Mass: 499.2781
Source ID: CNP0372740.5
  • CAS Registry: 509-20-6
  • KEGG: C19990
  • LipidMAPS:
  • BioCYC:
L-Iditol

Formula: C6H14O6
Exact Mass: 182.079
Source ID: CNP0190948.5
  • CAS Registry: 488-45-9
  • KEGG: C01507
  • LipidMAPS:
  • BioCYC: CPD-369
1-Octen-3-one

Formula: C8H14O
Exact Mass: 126.1045
Source ID: CNP0297364.0
  • CAS Registry: 4312-99-6
  • KEGG:
  • LipidMAPS: LMFA12000011
  • BioCYC:
L-Noradrenaline

Formula: C8H11NO3
Exact Mass: 169.0739
Source ID: CNP0214798.2
  • CAS Registry: 51-41-2
  • KEGG: C00547
  • LipidMAPS:
  • BioCYC:
(E)-2-Hexenal

Formula: C6H10O
Exact Mass: 98.0732
Source ID: CNP0263913.0
  • CAS Registry: 6728-26-3
  • KEGG: C08497
  • LipidMAPS: LMFA06000002
  • BioCYC: TRANS-2-HEXENAL
4-Methylcatechol

Formula: C7H8O2
Exact Mass: 124.0524
Source ID: CNP0114802.0
  • CAS Registry: 452-86-8
  • KEGG: C06730
  • LipidMAPS:
  • BioCYC: 4-METHYLCATECHOL
1-Undecene

Formula: C11H22
Exact Mass: 154.1721
Source ID: CNP0159463.0
  • CAS Registry: 821-95-4
  • KEGG:
  • LipidMAPS: LMFA11000332
  • BioCYC:


Formula: C15H24N2O2
Exact Mass: 264.1838
Source ID: CNP0334248.3
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Octyl acetate

Formula: C10H20O2
Exact Mass: 172.1463
Source ID: CNP0207320.0
  • CAS Registry: 112-14-1
  • KEGG:
  • LipidMAPS: LMFA07010197
  • BioCYC: CPD-22643
3,4-dihydro-2H-pyrrol-5-ol

Formula: C4H7NO
Exact Mass: 85.0528
Source ID: CNP0485346.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Propene-1-thiol

Formula: C3H6S
Exact Mass: 74.019
Source ID: CNP0575677.0
  • CAS Registry: 870-23-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Methyl-3-penten-2-one, 9CI

Formula: C6H10O
Exact Mass: 98.0732
Source ID: CNP0258331.0
  • CAS Registry: 141-79-7
  • KEGG:
  • LipidMAPS: LMFA12000030
  • BioCYC:
Butyl hexanoate

Formula: C10H20O2
Exact Mass: 172.1463
Source ID: CNP0132269.0
  • CAS Registry: 626-82-4
  • KEGG:
  • LipidMAPS: LMFA07010436
  • BioCYC:
1,2-Dihydro-1,1,6-trimethylnaphthalene

Formula: C13H16
Exact Mass: 172.1252
Source ID: CNP0256441.0
  • CAS Registry: 30364-38-6
  • KEGG: C74559
  • LipidMAPS:
  • BioCYC:
Ethyl 4-methylpentanoate

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0084329.0
  • CAS Registry: 25415-67-2
  • KEGG:
  • LipidMAPS: LMFA07010869
  • BioCYC:
Propane

Formula: C3H8
Exact Mass: 44.0626
Source ID: CNP0529348.0
  • CAS Registry: 74-98-6
  • KEGG: C20783
  • LipidMAPS:
  • BioCYC: CPD-18984
D-2-Aminobutyrate

Formula: C4H9NO2
Exact Mass: 103.0633
Source ID: CNP0243222.1
  • CAS Registry: 2623-91-8
  • KEGG: C02261
  • LipidMAPS: LMFA01100043
  • BioCYC: CPD0-1952
Hexylbenzene

Formula: C12H18
Exact Mass: 162.1408
Source ID: CNP0276048.0
  • CAS Registry: 1077-16-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Tridecene

Formula: C13H26
Exact Mass: 182.2034
Source ID: CNP0324663.0
  • CAS Registry: 2437-56-1
  • KEGG:
  • LipidMAPS: LMFA11000331
  • BioCYC:
D-Glucose 1-phosphate

Formula: C6H13O9P
Exact Mass: 260.0297
Source ID: CNP0189411.3
  • CAS Registry: 59-56-3
  • KEGG: C00103
  • LipidMAPS:
  • BioCYC: D-glucose-1-phosphates
Ethyl dodecanoate

Formula: C14H28O2
Exact Mass: 228.2089
Source ID: CNP0263071.0
  • CAS Registry: 106-33-2
  • KEGG:
  • LipidMAPS: LMFA07010464
  • BioCYC:
1,2,3-Trimethylbenzene

Formula: C9H12
Exact Mass: 120.0939
Source ID: CNP0219925.0
  • CAS Registry: 526-73-8
  • KEGG: C14518
  • LipidMAPS:
  • BioCYC:
3-Methylbutanal

Formula: C5H10O
Exact Mass: 86.0732
Source ID: CNP0200023.0
  • CAS Registry: 590-86-3
  • KEGG: C07329
  • LipidMAPS:
  • BioCYC: CPD-7031
N-acetyl-beta-neuraminic acid

Formula: C11H19NO9
Exact Mass: 309.106
Source ID: CNP0140848.1
  • CAS Registry: 19342-33-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Phenylephrine

Formula: C9H13NO2
Exact Mass: 167.0946
Source ID: CNP0319778.1
  • CAS Registry: 59-42-7
  • KEGG: C07441
  • LipidMAPS:
  • BioCYC:
Levulinic acid

Formula: C5H8O3
Exact Mass: 116.0473
Source ID: CNP0267906.0
  • CAS Registry: 123-76-2
  • KEGG:
  • LipidMAPS: LMFA01060006
  • BioCYC:
L-Arabinose

Formula: C5H10O5
Exact Mass: 150.0528
Source ID: CNP0207148.5
  • CAS Registry: 147-81-9
  • KEGG: C00259
  • LipidMAPS:
  • BioCYC: L-ARABINOSE
30-Hydroxy-11-oxo-beta-amyrin

Formula: C30H48O3
Exact Mass: 456.3603
Source ID: CNP0326904.1
  • CAS Registry: 14226-18-7
  • KEGG: C20510
  • LipidMAPS:
  • BioCYC: CPD-13670
Maltose

Formula: C12H22O11
Exact Mass: 342.1162
Source ID: CNP0226604.16
  • CAS Registry: 69-79-4
  • KEGG: C00208
  • LipidMAPS:
  • BioCYC:
3,4-Dimethylthiophene

Formula: C6H8S
Exact Mass: 112.0347
Source ID: CNP0084292.0
  • CAS Registry: 632-15-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Adipate

Formula: C6H10O4
Exact Mass: 146.0579
Source ID: CNP0296801.0
  • CAS Registry: 124-04-9
  • KEGG: C06104
  • LipidMAPS: LMFA01170048
  • BioCYC: ADIPATE
Ethanol

Formula: C2H6O
Exact Mass: 46.0419
Source ID: CNP0546367.0
  • CAS Registry: 64-17-5
  • KEGG: C00469
  • LipidMAPS:
  • BioCYC: ETOH
alpha-L-Sorbopyranose

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0266926.4
  • CAS Registry: 470-15-5
  • KEGG: C08356
  • LipidMAPS:
  • BioCYC: CPD-15986
(1R,2S)-1-[(6R)-4-hydroxy-2-imino-6,7-dihydro-1H-pteridin-6-yl]propane-1,2-diol

Formula: C9H13N5O3
Exact Mass: 239.1018
Source ID: CNP0481760.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
7-Methylxanthine

Formula: C6H6N4O2
Exact Mass: 166.0491
Source ID: CNP0578661.0
  • CAS Registry: 552-62-5
  • KEGG: C16353
  • LipidMAPS:
  • BioCYC: 7-METHYLXANTHINE
Ethyl isovalerate

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0224486.0
  • CAS Registry: 108-64-5
  • KEGG: C12290
  • LipidMAPS: LMFA07010511
  • BioCYC:
9(S)-HOT

Formula: C18H30O3
Exact Mass: 294.2195
Source ID: CNP0359787.1
  • CAS Registry: 89886-42-0
  • KEGG: C16326
  • LipidMAPS: LMFA02000024
  • BioCYC:
Octanal

Formula: C8H16O
Exact Mass: 128.1201
Source ID: CNP0146292.0
  • CAS Registry: 124-13-0
  • KEGG: C01545
  • LipidMAPS: LMFA06000028
  • BioCYC: CPD-371
3-Methyl-2-butenal

Formula: C5H8O
Exact Mass: 84.0575
Source ID: CNP0325416.0
  • CAS Registry: 107-86-8
  • KEGG: C07330
  • LipidMAPS:
  • BioCYC: PRENAL
Cholestan-3-ol

Formula: C27H48O
Exact Mass: 388.3705
Source ID: CNP0188747.4
  • CAS Registry: 17608-41-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pentyl propanoate

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0268077.0
  • CAS Registry: 624-54-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3(2-HYDROXYPHENYL)PROPANOATE

Formula: C9H10O3
Exact Mass: 166.063
Source ID: CNP0103376.0
  • CAS Registry: 495-78-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
L-Ornithine

Formula: C5H12N2O2
Exact Mass: 132.0899
Source ID: CNP0102727.1
  • CAS Registry: 70-26-8
  • KEGG: C00077
  • LipidMAPS:
  • BioCYC: ORNITHINE
3'-AMP

Formula: C10H14N5O7P
Exact Mass: 347.0631
Source ID: CNP0153138.1
  • CAS Registry: 84-21-9
  • KEGG: C01367
  • LipidMAPS:
  • BioCYC:
Acetic anhydride

Formula: C4H6O3
Exact Mass: 102.0317
Source ID: CNP0296904.0
  • CAS Registry: 108-24-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5'-aminoimidazole-4-carboxamide-1-beta-D-ribofuranosyl 5'-monophosphate

Formula: C9H15N4O8P
Exact Mass: 338.0627
Source ID: CNP0208947.1
  • CAS Registry: 3031-94-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
alpha-Maltose

Formula: C12H22O11
Exact Mass: 342.1162
Source ID: CNP0226604.17
  • CAS Registry: 4482-75-1
  • KEGG: C00897
  • LipidMAPS:
  • BioCYC: ALPHA-MALTOSE


Formula: C22H33NO3
Exact Mass: 359.246
Source ID: CNP0266696.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Methyl propionate

Formula: C4H8O2
Exact Mass: 88.0524
Source ID: CNP0166631.0
  • CAS Registry: 554-12-1
  • KEGG:
  • LipidMAPS: LMFA07010410
  • BioCYC: CPD-15782
Stigmastanol

Formula: C29H52O
Exact Mass: 416.4018
Source ID: CNP0234921.4
  • CAS Registry: 83-45-4
  • KEGG: C19644
  • LipidMAPS: LMST01040128
  • BioCYC: CPD-8481
MEGxm0_000472

Formula: C21H30O2
Exact Mass: 314.2246
Source ID: CNP0364236.3
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Safrole

Formula: C10H10O2
Exact Mass: 162.0681
Source ID: CNP0508090.0
  • CAS Registry: 94-59-7
  • KEGG: C10490
  • LipidMAPS:
  • BioCYC: CPD-21978
5,7-dihydroxy-2-(4-hydroxyphenyl)chromenylium-3-olate;hydrochloride

Formula: C15H11ClO5
Exact Mass: 306.0295
Source ID: CNP0502137.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isocaproic acid

Formula: C6H12O2
Exact Mass: 116.0837
Source ID: CNP0414918.0
  • CAS Registry: 646-07-1
  • KEGG:
  • LipidMAPS: LMFA01020076
  • BioCYC:
Scopolamine

Formula: C17H21NO4
Exact Mass: 303.1471
Source ID: CNP0257171.9
  • CAS Registry: 51-34-3
  • KEGG: C01851
  • LipidMAPS:
  • BioCYC: SCOPOLAMINE
Formaldehyde

Formula: CH2O
Exact Mass: 30.0106
Source ID: CNP0577301.0
  • CAS Registry: 50-00-0
  • KEGG: C00067
  • LipidMAPS:
  • BioCYC: FORMALDEHYDE
2,4-Dimethyl-3-pentanone

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0413157.0
  • CAS Registry: 565-80-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4-Di-tert-butylphenol

Formula: C14H22O
Exact Mass: 206.1671
Source ID: CNP0177836.0
  • CAS Registry: 96-76-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tridecane

Formula: C13H28
Exact Mass: 184.2191
Source ID: CNP0251262.0
  • CAS Registry: 629-50-5
  • KEGG: C13834
  • LipidMAPS: LMFA11000001
  • BioCYC: CPD-7949
p-tert-Amylphenol

Formula: C11H16O
Exact Mass: 164.1201
Source ID: CNP0085006.0
  • CAS Registry: 80-46-6
  • KEGG: C14226
  • LipidMAPS:
  • BioCYC:
Dodecane

Formula: C12H26
Exact Mass: 170.2034
Source ID: CNP0299960.0
  • CAS Registry: 112-40-3
  • KEGG: C08374
  • LipidMAPS: LMFA11000004
  • BioCYC: CPD-9290
PA(18:0/18:2(9Z,12Z))

Formula: C39H73O8P
Exact Mass: 700.5043
Source ID: CNP0042591.1
  • CAS Registry:
  • KEGG: C00416
  • LipidMAPS: LMGP10010036
  • BioCYC: CPD-8267
Methyl propyl disulfide

Formula: C4H10S2
Exact Mass: 122.0224
Source ID: CNP0296815.0
  • CAS Registry: 2179-60-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Dodecene

Formula: C12H24
Exact Mass: 168.1878
Source ID: CNP0173522.0
  • CAS Registry: 112-41-4
  • KEGG:
  • LipidMAPS: LMFA11000313
  • BioCYC:
4-oxo-1H-quinoline-2-carboxylic acid

Formula: C10H7NO3
Exact Mass: 189.0426
Source ID: CNP0333612.0
  • CAS Registry: 492-27-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,4-Bis(2-ethylhexyl) sulfosuccinate

Formula: C20H38O7S
Exact Mass: 422.2338
Source ID: CNP0085008.0
  • CAS Registry: 10041-19-7
  • KEGG: C07874
  • LipidMAPS: LMFA07010721
  • BioCYC:
Lacto-N-tetraose

Formula: C26H45NO21
Exact Mass: 707.2484
Source ID: CNP0177274.1
  • CAS Registry: 13007-32-4
  • KEGG: C06371
  • LipidMAPS:
  • BioCYC: CPD-16473
2-Methylcumarone

Formula: C9H8O
Exact Mass: 132.0575
Source ID: CNP0333088.0
  • CAS Registry: 4265-25-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Dichlorophenoxyacetic acid

Formula: C8H6Cl2O3
Exact Mass: 219.9694
Source ID: CNP0341289.0
  • CAS Registry: 94-75-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-Heptane

Formula: C7H16
Exact Mass: 100.1252
Source ID: CNP0290800.0
  • CAS Registry: 142-82-5
  • KEGG:
  • LipidMAPS: LMFA11000575
  • BioCYC: CPD-9286
2-Methylpentane

Formula: C6H14
Exact Mass: 86.1095
Source ID: CNP0319065.0
  • CAS Registry: 107-83-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methyl-3-buten-2-one

Formula: C5H8O
Exact Mass: 84.0575
Source ID: CNP0137327.0
  • CAS Registry: 814-78-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Hydroxypropionic acid

Formula: C3H6O3
Exact Mass: 90.0317
Source ID: CNP0228379.0
  • CAS Registry: 503-66-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,2,4-Trimethylbenzene

Formula: C9H12
Exact Mass: 120.0939
Source ID: CNP0110255.0
  • CAS Registry: 95-63-6
  • KEGG: C14533
  • LipidMAPS:
  • BioCYC: PSEUDOCUMENE
Dimethylbenzimidazole

Formula: C9H10N2
Exact Mass: 146.0844
Source ID: CNP0082942.0
  • CAS Registry: 582-60-5
  • KEGG: C03114
  • LipidMAPS:
  • BioCYC: DIMETHYLBENZIMIDAZOLE
Salicylaldehyde

Formula: C7H6O2
Exact Mass: 122.0368
Source ID: CNP0132365.0
  • CAS Registry: 90-02-8
  • KEGG: C06202
  • LipidMAPS:
  • BioCYC: SALICYLALDEHYDE
3H-indol-2-ol

Formula: C8H7NO
Exact Mass: 133.0528
Source ID: CNP0587736.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isoleucine

Formula: C6H13NO2
Exact Mass: 131.0946
Source ID: CNP0337843.3
  • CAS Registry: 443-79-8
  • KEGG: C16434
  • LipidMAPS:
  • BioCYC:
1-Dodecanol

Formula: C12H26O
Exact Mass: 186.1984
Source ID: CNP0281602.0
  • CAS Registry: 112-53-8
  • KEGG: C02277
  • LipidMAPS: LMFA05000001
  • BioCYC: CPD-7867
(1R,2R,4R)-Dihydrocarveol

Formula: C10H18O
Exact Mass: 154.1358
Source ID: CNP0390712.5
  • CAS Registry: 20549-47-7
  • KEGG: C11396
  • LipidMAPS: LMPR0102090031
  • BioCYC: CPD-10027
Limonene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0282017.2
  • CAS Registry: 138-86-3
  • KEGG: C06078
  • LipidMAPS:
  • BioCYC: Limonenes
(R)-Lipoate

Formula: C8H14O2S2
Exact Mass: 206.0435
Source ID: CNP0120491.1
  • CAS Registry: 1200-22-2
  • KEGG: C16241
  • LipidMAPS: LMFA01130001
  • BioCYC: LIPOIC-ACID
(2S)-2-[[4-[[(6S)-4-hydroxy-2-imino-5-methyl-1,6,7,8-tetrahydropteridin-6-yl]methylamino]benzoyl]amino]pentanedioic acid

Formula: C20H25N7O6
Exact Mass: 459.1866
Source ID: CNP0502714.3
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
beta-Tocopherol

Formula: C28H48O2
Exact Mass: 416.3654
Source ID: CNP0242100.1
  • CAS Registry: 148-03-8
  • KEGG: C14152
  • LipidMAPS: LMPR02020059
  • BioCYC: BETA-TOCOPHEROL
Phthalate

Formula: C8H6O4
Exact Mass: 166.0266
Source ID: CNP0324589.0
  • CAS Registry: 88-99-3
  • KEGG: C01606
  • LipidMAPS:
  • BioCYC:
Isopropyl_laurate

Formula: C15H30O2
Exact Mass: 242.2246
Source ID: CNP0353162.0
  • CAS Registry: 10233-13-3
  • KEGG:
  • LipidMAPS: LMFA07010674
  • BioCYC:
trans-Muurola-4(14),5-diene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0144185.2
  • CAS Registry: 262352-87-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Methylpentanal

Formula: C6H12O
Exact Mass: 100.0888
Source ID: CNP0198082.0
  • CAS Registry: 1119-16-0
  • KEGG: C02373
  • LipidMAPS: LMFA06000109
  • BioCYC: HEXANAL
2-Amino-3-carboxymuconate semialdehyde

Formula: C7H7NO5
Exact Mass: 185.0324
Source ID: CNP0318725.0
  • CAS Registry: 16597-19-6
  • KEGG: C04409
  • LipidMAPS:
  • BioCYC:
[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-hydroxy-2-imino-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate

Formula: C10H14N5O8P
Exact Mass: 363.058
Source ID: CNP0513947.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
myo-Inositol

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0254016.5
  • CAS Registry: 87-89-8
  • KEGG: C00137
  • LipidMAPS:
  • BioCYC: MYO-INOSITOL
5-Amino-4-imidazolecarboxyamide

Formula: C4H6N4O
Exact Mass: 126.0542
Source ID: CNP0545145.0
  • CAS Registry: 360-97-4
  • KEGG: C04051
  • LipidMAPS:
  • BioCYC: CPD-3762
4-Hydroxyaniline

Formula: C6H7NO
Exact Mass: 109.0528
Source ID: CNP0149529.0
  • CAS Registry: 123-30-8
  • KEGG: C02372
  • LipidMAPS:
  • BioCYC: CPD-259
(-)-trans-Carveol

Formula: C10H16O
Exact Mass: 152.1201
Source ID: CNP0250789.4
  • CAS Registry: 2102-58-1
  • KEGG: C00964
  • LipidMAPS: LMPR0102090005
  • BioCYC:
2-hydroxy-1,7-dimethylpurin-6-one

Formula: C7H8N4O2
Exact Mass: 180.0647
Source ID: CNP0589379.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Urea

Formula: CH4N2O
Exact Mass: 60.0324
Source ID: CNP0520286.0
  • CAS Registry: 57-13-6
  • KEGG: C00086
  • LipidMAPS:
  • BioCYC: UREA
Propylparaben

Formula: C10H12O3
Exact Mass: 180.0786
Source ID: CNP0333884.0
  • CAS Registry: 94-13-3
  • KEGG: D01422
  • LipidMAPS:
  • BioCYC:
Diphenyl ether

Formula: C12H10O
Exact Mass: 170.0732
Source ID: CNP0246862.0
  • CAS Registry: 101-84-8
  • KEGG: C07733
  • LipidMAPS:
  • BioCYC: CPD-18739
Indoxyl sulfate

Formula: C8H7NO4S
Exact Mass: 213.0096
Source ID: CNP0308395.0
  • CAS Registry: 487-94-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pregnenolone

Formula: C21H32O2
Exact Mass: 316.2402
Source ID: CNP0185007.2
  • CAS Registry: 145-13-1
  • KEGG: C01953
  • LipidMAPS: LMST02030088
  • BioCYC: PREGNENOLONE
(+)-(1S,2S)-Pseudoephedrine

Formula: C10H15NO
Exact Mass: 165.1154
Source ID: CNP0171581.5
  • CAS Registry: 90-82-4
  • KEGG: C02765
  • LipidMAPS:
  • BioCYC: CPD-9954
Pyridine

Formula: C5H5N
Exact Mass: 79.0422
Source ID: CNP0160377.0
  • CAS Registry: 110-86-1
  • KEGG: C00747
  • LipidMAPS:
  • BioCYC: PYRIDINE-RING
Pyridoxal phosphate

Formula: C8H10NO6P
Exact Mass: 247.0246
Source ID: CNP0165521.0
  • CAS Registry: 54-47-7
  • KEGG: C00018
  • LipidMAPS:
  • BioCYC:
Xylitol

Formula: C5H12O5
Exact Mass: 152.0685
Source ID: CNP0264488.4
  • CAS Registry: 87-99-0
  • KEGG: C00379
  • LipidMAPS:
  • BioCYC: XYLITOL
Guanine

Formula: C5H5N5O
Exact Mass: 151.0494
Source ID: CNP0485075.0
  • CAS Registry: 73-40-5
  • KEGG: C00242
  • LipidMAPS:
  • BioCYC: GUANINE
Soybean lecithin

Formula: C42H80NO8P
Exact Mass: 757.5621
Source ID: CNP0594016.1
  • CAS Registry: 8002-43-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2R,3R,4S,5R)-2-(6-hydroxy-2-imino-3H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Formula: C10H13N5O5
Exact Mass: 283.0917
Source ID: CNP0560283.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
D-Gluconic acid

Formula: C6H12O7
Exact Mass: 196.0583
Source ID: CNP0198480.3
  • CAS Registry: 526-95-4
  • KEGG: C00257
  • LipidMAPS:
  • BioCYC: GLUCONATE
2-Methylpropyl 3-methylbutanoate

Formula: C9H18O2
Exact Mass: 158.1307
Source ID: CNP0361085.0
  • CAS Registry: 589-59-3
  • KEGG:
  • LipidMAPS: LMFA07010727
  • BioCYC:
sn-Glycerol 3-phosphate

Formula: C3H9O6P
Exact Mass: 172.0137
Source ID: CNP0375698.1
  • CAS Registry: 17989-41-2
  • KEGG: C00093
  • LipidMAPS:
  • BioCYC: GLYCEROL-3P
4-Ethyl-o-xylene

Formula: C10H14
Exact Mass: 134.1095
Source ID: CNP0111798.0
  • CAS Registry: 934-80-5
  • KEGG: C77212
  • LipidMAPS:
  • BioCYC:
3-Ethylphenol

Formula: C8H10O
Exact Mass: 122.0732
Source ID: CNP0135916.0
  • CAS Registry: 620-17-7
  • KEGG: C14386
  • LipidMAPS:
  • BioCYC:
L-Carnitine

Formula: C7H15NO3
Exact Mass: 161.1052
Source ID: CNP0533545.2
  • CAS Registry: 541-15-1
  • KEGG: C00318
  • LipidMAPS:
  • BioCYC: CARNITINE
Ethyl salicylate

Formula: C9H10O3
Exact Mass: 166.063
Source ID: CNP0169358.0
  • CAS Registry: 118-61-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-(3-O-sulfo-beta-D-galactosyl)-N-tetracosanoylsphingosine

Formula: C48H93NO11S
Exact Mass: 891.6469
Source ID: CNP0261206.1
  • CAS Registry: 151122-71-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methylpentane

Formula: C6H14
Exact Mass: 86.1095
Source ID: CNP0316485.0
  • CAS Registry: 96-14-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methylpyridine

Formula: C6H7N
Exact Mass: 93.0578
Source ID: CNP0206932.0
  • CAS Registry: 108-99-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,6-Dimethylnaphthalene

Formula: C12H12
Exact Mass: 156.0939
Source ID: CNP0206738.0
  • CAS Registry: 581-42-0
  • KEGG: C14330
  • LipidMAPS:
  • BioCYC:
L-Octanoylcarnitine

Formula: C15H29NO4
Exact Mass: 287.2096
Source ID: CNP0603707.1
  • CAS Registry: 25243-95-2
  • KEGG: C02838
  • LipidMAPS: LMFA07070002
  • BioCYC: L-OCTANOYLCARNITINE
(-)-Menthol

Formula: C10H20O
Exact Mass: 156.1514
Source ID: CNP0243697.6
  • CAS Registry: 2216-51-5
  • KEGG: C00400
  • LipidMAPS: LMPR0102090001
  • BioCYC: --MENTHOL
Lithocholic acid

Formula: C24H40O3
Exact Mass: 376.2977
Source ID: CNP0202730.2
  • CAS Registry: 434-13-9
  • KEGG: C03990
  • LipidMAPS: LMST04010003
  • BioCYC: CPD-7235
D-Sorbitol

Formula: C6H14O6
Exact Mass: 182.079
Source ID: CNP0190948.6
  • CAS Registry: 50-70-4
  • KEGG: C00794
  • LipidMAPS:
  • BioCYC: SORBITOL
(-)-beta-Phellandrene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0204388.1
  • CAS Registry: 6153-17-9
  • KEGG: C11392
  • LipidMAPS:
  • BioCYC: CPD-8768
Cotinine

Formula: C10H12N2O
Exact Mass: 176.095
Source ID: CNP0148535.1
  • CAS Registry: 486-56-6
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-2742
Methyl stearate

Formula: C19H38O2
Exact Mass: 298.2872
Source ID: CNP0105908.0
  • CAS Registry: 112-61-8
  • KEGG:
  • LipidMAPS: LMFA07010474
  • BioCYC:
2-Nonadecanone

Formula: C19H38O
Exact Mass: 282.2922
Source ID: CNP0183458.0
  • CAS Registry: 629-66-3
  • KEGG:
  • LipidMAPS: LMFA12000051
  • BioCYC: CPD-7896
Cyclohexanone

Formula: C6H10O
Exact Mass: 98.0732
Source ID: CNP0271526.0
  • CAS Registry: 108-94-1
  • KEGG: C00414
  • LipidMAPS:
  • BioCYC: CYCLOHEXANONE
delta-Cadinene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0357544.3
  • CAS Registry: 483-76-1
  • KEGG: C06394
  • LipidMAPS: LMPR0103330001
  • BioCYC: CPD-1722
2-isopropylmalic acid

Formula: C7H12O5
Exact Mass: 176.0685
Source ID: CNP0231884.1
  • CAS Registry: 3237-44-3
  • KEGG: C02504
  • LipidMAPS:
  • BioCYC:
Hexyl salicylic acid

Formula: C13H18O3
Exact Mass: 222.1256
Source ID: CNP0084718.0
  • CAS Registry: 6259-76-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(+)-beta-Phellandrene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0204388.2
  • CAS Registry: 6153-16-8
  • KEGG: C09877
  • LipidMAPS: LMPR0102090022
  • BioCYC: CPD-8769
1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-hydroxypyrimidin-2-one

Formula: C9H12N2O6
Exact Mass: 244.0695
Source ID: CNP0553636.4
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Prostaglandin B1

Formula: C20H32O4
Exact Mass: 336.23
Source ID: CNP0241053.1
  • CAS Registry: 13345-51-2
  • KEGG: C00959
  • LipidMAPS: LMFA03010131
  • BioCYC:
2,5-Dimethylfuran

Formula: C6H8O
Exact Mass: 96.0575
Source ID: CNP0204172.0
  • CAS Registry: 625-86-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,6-Dimethoxybenzoic acid

Formula: C9H10O4
Exact Mass: 182.0579
Source ID: CNP0188516.0
  • CAS Registry: 1466-76-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,6-di-tert-butylphenol

Formula: C14H22O
Exact Mass: 206.1671
Source ID: CNP0102088.0
  • CAS Registry: 128-39-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
D-Ribonate

Formula: C5H10O6
Exact Mass: 166.0477
Source ID: CNP0348844.2
  • CAS Registry: 642-98-8
  • KEGG: C01685
  • LipidMAPS:
  • BioCYC:
1,5-Anhydro-D-glucitol

Formula: C6H12O5
Exact Mass: 164.0685
Source ID: CNP0228210.2
  • CAS Registry: 154-58-5
  • KEGG: C07326
  • LipidMAPS:
  • BioCYC: 15-ANHYDRO-D-GLUCITOL
beta-Terpinene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0371401.0
  • CAS Registry: 99-84-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Thymine

Formula: C5H6N2O2
Exact Mass: 126.0429
Source ID: CNP0517257.0
  • CAS Registry: 65-71-4
  • KEGG: C00178
  • LipidMAPS:
  • BioCYC: THYMINE
2-Ethyltoluene

Formula: C9H12
Exact Mass: 120.0939
Source ID: CNP0106326.0
  • CAS Registry: 611-14-3
  • KEGG: C14572
  • LipidMAPS:
  • BioCYC:
Ethyl isopropyl ketone

Formula: C6H12O
Exact Mass: 100.0888
Source ID: CNP0169958.0
  • CAS Registry: 565-69-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Octopamine

Formula: C8H11NO2
Exact Mass: 153.079
Source ID: CNP0139359.2
  • CAS Registry: 104-14-3
  • KEGG: C04227
  • LipidMAPS:
  • BioCYC:
(2S)-2-[[4-[(5-formyl-4-hydroxy-2-imino-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid

Formula: C20H23N7O7
Exact Mass: 473.1659
Source ID: CNP0567692.4
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
7-Dehydrocholesterol

Formula: C27H44O
Exact Mass: 384.3392
Source ID: CNP0167595.2
  • CAS Registry: 434-16-2
  • KEGG: C01164
  • LipidMAPS: LMST01010069
  • BioCYC: CPD-4187
Guanosine

Formula: C10H16N5O14P3
Exact Mass: 522.9907
Source ID: CNP0582224.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Viridiflorene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0233156.2
  • CAS Registry: 21747-46-6
  • KEGG: C20162
  • LipidMAPS:
  • BioCYC: CPD-13857
2,6-Dihydroxybenzoic acid

Formula: C7H6O4
Exact Mass: 154.0266
Source ID: CNP0200151.0
  • CAS Registry: 303-07-1
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-8816
D-Ornithine

Formula: C5H12N2O2
Exact Mass: 132.0899
Source ID: CNP0102727.2
  • CAS Registry: 348-66-3
  • KEGG: C00515
  • LipidMAPS:
  • BioCYC: CPD-217
Melibiose

Formula: C12H22O11
Exact Mass: 342.1162
Source ID: CNP0212546.11
  • CAS Registry: 585-99-9
  • KEGG: C05402
  • LipidMAPS:
  • BioCYC: MELIBIOSE
Benzo[a]pyrene

Formula: C20H12
Exact Mass: 252.0939
Source ID: CNP0381277.0
  • CAS Registry: 50-32-8
  • KEGG: C07535
  • LipidMAPS:
  • BioCYC:
(-)-beta-Pinene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0210402.3
  • CAS Registry: 18172-67-3
  • KEGG: C06307
  • LipidMAPS: LMPR0102120013
  • BioCYC: CPD-4891
1,6,7-Trimethylnaphthalene

Formula: C13H14
Exact Mass: 170.1095
Source ID: CNP0265529.0
  • CAS Registry: 2245-38-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
L-Fucose

Formula: C6H12O5
Exact Mass: 164.0685
Source ID: CNP0226197.6
  • CAS Registry: 2438-80-4
  • KEGG: C01019
  • LipidMAPS:
  • BioCYC: L-FUCOSE
Thyroxine

Formula: C15H11I4NO4
Exact Mass: 776.6867
Source ID: CNP0207509.1
  • CAS Registry: 51-48-9
  • KEGG: C01829
  • LipidMAPS:
  • BioCYC: THRYROXINE
1-Tetradecene

Formula: C14H28
Exact Mass: 196.2191
Source ID: CNP0137398.0
  • CAS Registry: 1120-36-1
  • KEGG:
  • LipidMAPS: LMFA11000329
  • BioCYC:
Cadalene

Formula: C15H18
Exact Mass: 198.1408
Source ID: CNP0274448.0
  • CAS Registry: 483-78-3
  • KEGG:
  • LipidMAPS: LMPR0103330007
  • BioCYC: CPD-8806
Estrone

Formula: C18H22O2
Exact Mass: 270.162
Source ID: CNP0395406.4
  • CAS Registry: 53-16-7
  • KEGG: C00468
  • LipidMAPS: LMST02010004
  • BioCYC: ESTRONE
Isopropyl dodecanoic acid

Formula: C13H26O2
Exact Mass: 214.1933
Source ID: CNP0080469.0
  • CAS Registry: 2311-59-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
alpha-Cubebene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0191793.2
  • CAS Registry: 17699-14-8
  • KEGG: C09647
  • LipidMAPS: LMPR0103440001
  • BioCYC: CPD-8739
7alpha-Hydroxycholesterol

Formula: C27H46O2
Exact Mass: 402.3498
Source ID: CNP0147119.3
  • CAS Registry: 566-26-7
  • KEGG: C03594
  • LipidMAPS: LMST01010013
  • BioCYC: CPD-266
4-Nitrophenol

Formula: C6H5NO3
Exact Mass: 139.0269
Source ID: CNP0593615.0
  • CAS Registry: 100-02-7
  • KEGG: C00870
  • LipidMAPS:
  • BioCYC: P-NITROPHENOL
Arachidyl alcohol

Formula: C20H42O
Exact Mass: 298.3235
Source ID: CNP0220937.0
  • CAS Registry: 629-96-9
  • KEGG:
  • LipidMAPS: LMFA05000221
  • BioCYC: CPD-7869
Propane-1-thiol

Formula: C3H8S
Exact Mass: 76.0347
Source ID: CNP0572992.0
  • CAS Registry: 107-03-9
  • KEGG: C08390
  • LipidMAPS:
  • BioCYC: CPD-21129
gamma-Muurolene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0123983.5
  • CAS Registry: 24268-39-1
  • KEGG: C20273
  • LipidMAPS:
  • BioCYC: CPD-8791
Lactose

Formula: C12H22O11
Exact Mass: 342.1162
Source ID: CNP0226604.22
  • CAS Registry: 63-42-3
  • KEGG: C00243
  • LipidMAPS:
  • BioCYC: CPD-15972
Oenanthic ether

Formula: C9H18O2
Exact Mass: 158.1307
Source ID: CNP0228643.0
  • CAS Registry: 106-30-9
  • KEGG:
  • LipidMAPS: LMFA07010984
  • BioCYC:
Cholest-4-en-3-one

Formula: C27H44O
Exact Mass: 384.3392
Source ID: CNP0265358.1
  • CAS Registry: 601-57-0
  • KEGG: C00599
  • LipidMAPS: LMST01010015
  • BioCYC: CPD-323
Lanosterol

Formula: C30H50O
Exact Mass: 426.3861
Source ID: CNP0207495.7
  • CAS Registry: 79-63-0
  • KEGG: C01724
  • LipidMAPS: LMST01010017
  • BioCYC: LANOSTEROL
Thiophene

Formula: C4H4S
Exact Mass: 84.0034
Source ID: CNP0604134.0
  • CAS Registry: 110-02-1
  • KEGG: C02595
  • LipidMAPS:
  • BioCYC:
5-Methyl-2-hexanone

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0109911.0
  • CAS Registry: 110-12-3
  • KEGG:
  • LipidMAPS: LMFA12000037
  • BioCYC:
Ribitol

Formula: C5H12O5
Exact Mass: 152.0685
Source ID: CNP0264488.5
  • CAS Registry: 488-81-3
  • KEGG: C00474
  • LipidMAPS:
  • BioCYC: RIBITOL
Butyl formate

Formula: C5H10O2
Exact Mass: 102.0681
Source ID: CNP0282325.0
  • CAS Registry: 592-84-7
  • KEGG: C21713
  • LipidMAPS:
  • BioCYC: CPD-18956
Hydroxyacetone

Formula: C3H6O2
Exact Mass: 74.0368
Source ID: CNP0487266.0
  • CAS Registry: 116-09-6
  • KEGG: C05235
  • LipidMAPS:
  • BioCYC: ACETOL
alpha-Copaene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0246337.10
  • CAS Registry: 3856-25-5
  • KEGG: C09639
  • LipidMAPS:
  • BioCYC: CPD-8234
1-Benzhydryl-3-[4-(methoxy-quinolin-8-ylamino)-pentyl]-urea

Formula: C30H33N3O2
Exact Mass: 467.2573
Source ID: CNP0503929.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4-Dimethyladipic acid

Formula: C8H14O4
Exact Mass: 174.0892
Source ID: CNP0084063.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
L-Norleucine

Formula: C6H13NO2
Exact Mass: 131.0946
Source ID: CNP0177876.1
  • CAS Registry: 327-57-1
  • KEGG: C01933
  • LipidMAPS: LMFA01100042
  • BioCYC: L-2-AMINOHEXANOATE
3-Methyl-3-buten-1-ol

Formula: C5H10O
Exact Mass: 86.0732
Source ID: CNP0285127.0
  • CAS Registry: 763-32-6
  • KEGG:
  • LipidMAPS: LMFA05000107
  • BioCYC:
4-Methyl-2-oxopentanoate

Formula: C6H10O3
Exact Mass: 130.063
Source ID: CNP0271985.0
  • CAS Registry: 816-66-0
  • KEGG: C00233
  • LipidMAPS:
  • BioCYC: 2K-4CH3-PENTANOATE
tetratetracontane

Formula: C44H90
Exact Mass: 618.7042
Source ID: CNP0121040.0
  • CAS Registry: 7098-22-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methoxybenzoic acid

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0251972.0
  • CAS Registry: 586-38-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Guanidino-2-oxopentanoate

Formula: C6H11N3O3
Exact Mass: 173.08
Source ID: CNP0564822.0
  • CAS Registry: 3715-10-4
  • KEGG: C03771
  • LipidMAPS:
  • BioCYC: CPD-824
4-methylundecane

Formula: C12H26
Exact Mass: 170.2034
Source ID: CNP0333661.0
  • CAS Registry: 2980-69-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,3,5,8-Tetramethyldecane

Formula: C14H30
Exact Mass: 198.2347
Source ID: CNP0083064.0
  • CAS Registry: 192823-15-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Methylfuran

Formula: C5H6O
Exact Mass: 82.0419
Source ID: CNP0204821.0
  • CAS Registry: 534-22-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2S)-2-Ethylhexyl acetate

Formula: C10H20O2
Exact Mass: 172.1463
Source ID: CNP0084871.1
  • CAS Registry: 50373-28-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
MG(18:2(9Z,12Z)/0:0/0:0)

Formula: C21H38O4
Exact Mass: 354.277
Source ID: CNP0177983.3
  • CAS Registry: 67968-46-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Prenol

Formula: C5H10O
Exact Mass: 86.0732
Source ID: CNP0241702.0
  • CAS Registry: 556-82-1
  • KEGG: C01390
  • LipidMAPS: LMFA05000106
  • BioCYC: PRENOL
Imidazole-4-acetate

Formula: C5H6N2O2
Exact Mass: 126.0429
Source ID: CNP0253943.0
  • CAS Registry: 645-65-8
  • KEGG: C02835
  • LipidMAPS:
  • BioCYC: 4-IMIDAZOLEACETATE
Isopropyl hexadecanoate

Formula: C19H38O2
Exact Mass: 298.2872
Source ID: CNP0083050.0
  • CAS Registry: 142-91-6
  • KEGG:
  • LipidMAPS: LMFA07010675
  • BioCYC:
Isopropyl tetradecanoate

Formula: C17H34O2
Exact Mass: 270.2559
Source ID: CNP0084013.0
  • CAS Registry: 110-27-0
  • KEGG:
  • LipidMAPS: LMFA07010677
  • BioCYC:
Propyl hexanoate

Formula: C9H18O2
Exact Mass: 158.1307
Source ID: CNP0003080.0
  • CAS Registry: 626-77-7
  • KEGG:
  • LipidMAPS: LMFA07010435
  • BioCYC:
Isothiocyanatocyclopropane

Formula: C4H5NS
Exact Mass: 99.0143
Source ID: CNP0158262.0
  • CAS Registry: 56601-42-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Uracil

Formula: C4H4N2O2
Exact Mass: 112.0273
Source ID: CNP0482999.0
  • CAS Registry: 66-22-8
  • KEGG: C00106
  • LipidMAPS:
  • BioCYC: URACIL
2-Butylfuran

Formula: C8H12O
Exact Mass: 124.0888
Source ID: CNP0200391.0
  • CAS Registry: 4466-24-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Monomethyl phthalate

Formula: C9H8O4
Exact Mass: 180.0423
Source ID: CNP0084158.0
  • CAS Registry: 4376-18-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-(2,6,6-Trimethyl-1,3-cyclohexadien-1-yl)-2-butanone

Formula: C13H20O
Exact Mass: 192.1514
Source ID: CNP0084872.0
  • CAS Registry: 20483-36-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Methyl-4-pentenoic acid

Formula: C6H10O2
Exact Mass: 114.0681
Source ID: CNP0293941.0
  • CAS Registry: 1575-74-2
  • KEGG:
  • LipidMAPS: LMFA01030972
  • BioCYC:
Phloretate

Formula: C9H10O3
Exact Mass: 166.063
Source ID: CNP0290882.0
  • CAS Registry: 501-97-3
  • KEGG: C01744
  • LipidMAPS:
  • BioCYC:
FSL0613

Formula: C5H4N4O
Exact Mass: 136.0385
Source ID: CNP0601562.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Histidine

Formula: C6H9N3O2
Exact Mass: 155.0695
Source ID: CNP0584490.2
  • CAS Registry: 4998-57-6
  • KEGG: C00768
  • LipidMAPS:
  • BioCYC:
alpha-Muurolene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0163726.6
  • CAS Registry: 10208-80-7
  • KEGG: C20272
  • LipidMAPS:
  • BioCYC: CPD-8798
(8~{S})-8,9-dihydro-7~{H}-purine-2,6,8-triol

Formula: C5H6N4O3
Exact Mass: 170.044
Source ID: CNP0557741.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pentyl acetate

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0227990.0
  • CAS Registry: 628-63-7
  • KEGG:
  • LipidMAPS: LMFA07010176
  • BioCYC:
2,7,10-trimethyldodecane

Formula: C15H32
Exact Mass: 212.2504
Source ID: CNP0082477.0
  • CAS Registry: 74645-98-0
  • KEGG:
  • LipidMAPS: LMFA11000686
  • BioCYC:
methyl 3-(3-hydroxyphenyl)prop-2-enoate

Formula: C10H10O3
Exact Mass: 178.063
Source ID: CNP0082062.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(R)-Lactate

Formula: C3H6O3
Exact Mass: 90.0317
Source ID: CNP0232038.2
  • CAS Registry: 10326-41-7
  • KEGG: C00256
  • LipidMAPS: LMFA01050002
  • BioCYC:
Linalyl anthranilate

Formula: C17H23NO2
Exact Mass: 273.1729
Source ID: CNP0296170.0
  • CAS Registry: 7149-26-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(1S,4S)-Dihydrocarvone

Formula: C10H16O
Exact Mass: 152.1201
Source ID: CNP0183834.5
  • CAS Registry: 6909-25-7
  • KEGG: C11415
  • LipidMAPS: LMPR0102090039
  • BioCYC: CPD-10041
9Z-Heptadecenoic acid

Formula: C17H32O2
Exact Mass: 268.2402
Source ID: CNP0307035.0
  • CAS Registry: 1981-50-6
  • KEGG: C16536
  • LipidMAPS:
  • BioCYC:
(E)-2-Octen-1-ol

Formula: C8H16O
Exact Mass: 128.1201
Source ID: CNP0113756.0
  • CAS Registry: 18409-17-1
  • KEGG:
  • LipidMAPS: LMFA05000126
  • BioCYC:
Ethyl decanoate

Formula: C12H24O2
Exact Mass: 200.1776
Source ID: CNP0245893.0
  • CAS Registry: 110-38-3
  • KEGG:
  • LipidMAPS: LMFA07010455
  • BioCYC: CPD-22380
2-Amino-4-hydroxy-6-pteridinecarboxylic acid

Formula: C7H5N5O3
Exact Mass: 207.0392
Source ID: CNP0576758.0
  • CAS Registry: 948-60-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isobutanol

Formula: C4H10O
Exact Mass: 74.0732
Source ID: CNP0493868.0
  • CAS Registry: 78-83-1
  • KEGG: C14710
  • LipidMAPS: LMFA05000100
  • BioCYC: ISOBUTANOL
Isobutyraldehyde

Formula: C4H8O
Exact Mass: 72.0575
Source ID: CNP0511471.0
  • CAS Registry: 78-84-2
  • KEGG: C22919
  • LipidMAPS:
  • BioCYC:
Cumene

Formula: C9H12
Exact Mass: 120.0939
Source ID: CNP0123409.0
  • CAS Registry: 98-82-8
  • KEGG: C14396
  • LipidMAPS:
  • BioCYC: CPD0-2360
Ethyl hexanoate

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0149883.0
  • CAS Registry: 123-66-0
  • KEGG:
  • LipidMAPS: LMFA07010434
  • BioCYC: CPD-10093
(-)-Citronellol

Formula: C10H20O
Exact Mass: 156.1514
Source ID: CNP0152105.2
  • CAS Registry: 7540-51-4
  • KEGG: C11386
  • LipidMAPS: LMPR0102010012
  • BioCYC: CPD-7980
Cyclotetradecane

Formula: C14H28
Exact Mass: 196.2191
Source ID: CNP0320476.0
  • CAS Registry: 295-17-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Hircinol

Formula: C15H14O3
Exact Mass: 242.0943
Source ID: CNP0147833.0
  • CAS Registry: 41060-05-3
  • KEGG: C10261
  • LipidMAPS:
  • BioCYC:
5-Hydroxymethyl-2-furoate

Formula: C6H6O4
Exact Mass: 142.0266
Source ID: CNP0283460.0
  • CAS Registry: 6338-41-6
  • KEGG: C20448
  • LipidMAPS:
  • BioCYC: CPD-14103
Oxaloacetate

Formula: C4H4O5
Exact Mass: 132.0059
Source ID: CNP0390338.0
  • CAS Registry: 328-42-7
  • KEGG: C00036
  • LipidMAPS: LMFA01170120
  • BioCYC: OXALACETIC_ACID
UMP

Formula: C9H13N2O9P
Exact Mass: 324.0359
Source ID: CNP0506476.1
  • CAS Registry: 58-97-9
  • KEGG: C00105
  • LipidMAPS:
  • BioCYC: UMP
alpha-Curcumene

Formula: C15H22
Exact Mass: 202.1721
Source ID: CNP0403286.2
  • CAS Registry: 4176-17-4
  • KEGG: C09649
  • LipidMAPS: LMPR0103060015
  • BioCYC: CPD-14200
Methyl heptanoate

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0149439.0
  • CAS Registry: 106-73-0
  • KEGG:
  • LipidMAPS: LMFA07010961
  • BioCYC:
2-(alpha-D-galactosyl)glycerol

Formula: C9H18O8
Exact Mass: 254.1002
Source ID: CNP0264831.1
  • CAS Registry: 3879-81-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Picolinic acid

Formula: C6H5NO2
Exact Mass: 123.032
Source ID: CNP0288286.0
  • CAS Registry: 98-98-6
  • KEGG: C10164
  • LipidMAPS:
  • BioCYC: PICOLINATE
Methyl 3-methylbutanoate

Formula: C6H12O2
Exact Mass: 116.0837
Source ID: CNP0289344.0
  • CAS Registry: 556-24-1
  • KEGG:
  • LipidMAPS: LMFA07010950
  • BioCYC:
beta-D-glucosyl-N-(dodecanoyl)sphingosine

Formula: C36H69NO8
Exact Mass: 643.5023
Source ID: CNP0240444.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Methyl Phenylglyoxalate

Formula: C9H8O3
Exact Mass: 164.0473
Source ID: CNP0304624.0
  • CAS Registry: 15206-55-0
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-23541
(S)-2-Methylbutanal

Formula: C5H10O
Exact Mass: 86.0732
Source ID: CNP0220551.1
  • CAS Registry: 1730-97-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-Methyl-L-glutamate

Formula: C6H11NO4
Exact Mass: 161.0688
Source ID: CNP0330606.1
  • CAS Registry: 35989-16-3
  • KEGG: C01046
  • LipidMAPS:
  • BioCYC:
Galactitol

Formula: C6H14O6
Exact Mass: 182.079
Source ID: CNP0190948.8
  • CAS Registry: 608-66-2
  • KEGG: C01697
  • LipidMAPS:
  • BioCYC: GALACTITOL
Isopimaric acid

Formula: C20H30O2
Exact Mass: 302.2246
Source ID: CNP0195275.3
  • CAS Registry: 5835-26-7
  • KEGG: C09118
  • LipidMAPS: LMPR0104080010
  • BioCYC:
Deoxyinosine

Formula: C10H12N4O4
Exact Mass: 252.0859
Source ID: CNP0585751.1
  • CAS Registry: 890-38-0
  • KEGG: C05512
  • LipidMAPS:
  • BioCYC: DEOXYINOSINE
(R)-(-)-alpha-Phellandrene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0162506.2
  • CAS Registry: 99-83-2
  • KEGG: C09875
  • LipidMAPS: LMPR0102090021
  • BioCYC: CPD-18811
2-Methylpropyl butanoate

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0134371.0
  • CAS Registry: 539-90-2
  • KEGG:
  • LipidMAPS: LMFA07010728
  • BioCYC:
N-Acetylserine

Formula: C5H9NO4
Exact Mass: 147.0532
Source ID: CNP0157865.1
  • CAS Registry: 16354-58-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Heptanal

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0243745.0
  • CAS Registry: 111-71-7
  • KEGG: C14390
  • LipidMAPS: LMFA06000001
  • BioCYC: CPD-7620
(S)-2-Aminobutanoate

Formula: C4H9NO2
Exact Mass: 103.0633
Source ID: CNP0243222.3
  • CAS Registry: 1492-24-6
  • KEGG: C02356
  • LipidMAPS: LMFA01100034
  • BioCYC: CPD0-1942
2-Acetyl-5-methylfuran

Formula: C7H8O2
Exact Mass: 124.0524
Source ID: CNP0316616.0
  • CAS Registry: 1193-79-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Indole-3-methyl acetate

Formula: C11H11NO2
Exact Mass: 189.079
Source ID: CNP0242770.0
  • CAS Registry: 1912-33-0
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-10546
Methanethiol

Formula: CH4S
Exact Mass: 48.0034
Source ID: CNP0491451.0
  • CAS Registry: 74-93-1
  • KEGG: C00409
  • LipidMAPS:
  • BioCYC: CPD-7671
N,N-Dimethylacetamide

Formula: C4H9NO
Exact Mass: 87.0684
Source ID: CNP0083052.0
  • CAS Registry: 127-19-5
  • KEGG: C20339
  • LipidMAPS:
  • BioCYC:
Suberic acid

Formula: C8H14O4
Exact Mass: 174.0892
Source ID: CNP0210905.0
  • CAS Registry: 505-48-6
  • KEGG: C08278
  • LipidMAPS: LMFA01170001
  • BioCYC: CPD0-1264
Inosine

Formula: C10H12N4O5
Exact Mass: 268.0808
Source ID: CNP0330061.3
  • CAS Registry: 58-63-9
  • KEGG: C00294
  • LipidMAPS:
  • BioCYC: INOSINE
2,3-Octanedione

Formula: C8H14O2
Exact Mass: 142.0994
Source ID: CNP0172779.0
  • CAS Registry: 585-25-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-hydroxy-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one

Formula: C10H14N2O5
Exact Mass: 242.0903
Source ID: CNP0605913.3
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Ethoxy-4-oxobutanoic acid

Formula: C6H10O4
Exact Mass: 146.0579
Source ID: CNP0186824.0
  • CAS Registry: 1070-34-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Ethyl propionate

Formula: C5H10O2
Exact Mass: 102.0681
Source ID: CNP0169171.0
  • CAS Registry: 105-37-3
  • KEGG:
  • LipidMAPS: LMFA07010411
  • BioCYC: CPD-19958
2-Hydroxybiphenyl

Formula: C12H10O
Exact Mass: 170.0732
Source ID: CNP0248677.0
  • CAS Registry: 90-43-7
  • KEGG: C02499
  • LipidMAPS:
  • BioCYC: CPD-946
3-Hexanone

Formula: C6H12O
Exact Mass: 100.0888
Source ID: CNP0248158.0
  • CAS Registry: 589-38-8
  • KEGG:
  • LipidMAPS: LMFA12000049
  • BioCYC: CPD-13223
Methacrolein

Formula: C4H6O
Exact Mass: 70.0419
Source ID: CNP0479149.0
  • CAS Registry: 78-85-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Linalyl oxide

Formula: C10H18O2
Exact Mass: 170.1307
Source ID: CNP0293260.4
  • CAS Registry: 60047-17-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Butyl 3-methylbutanoate

Formula: C9H18O2
Exact Mass: 158.1307
Source ID: CNP0084165.0
  • CAS Registry: 109-19-3
  • KEGG:
  • LipidMAPS: LMFA07010652
  • BioCYC:
Pentacosanoic acid

Formula: C25H50O2
Exact Mass: 382.3811
Source ID: CNP0348718.0
  • CAS Registry: 506-38-7
  • KEGG:
  • LipidMAPS: LMFA01010025
  • BioCYC:
sodium ascorbate

Formula: C6H7NaO6
Exact Mass: 198.014
Source ID: CNP0550717.1
  • CAS Registry: 134-03-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Hexyl propionate

Formula: C9H18O2
Exact Mass: 158.1307
Source ID: CNP0139015.0
  • CAS Registry: 2445-76-3
  • KEGG:
  • LipidMAPS: LMFA07010413
  • BioCYC:
Isatin

Formula: C8H5NO2
Exact Mass: 147.032
Source ID: CNP0320767.0
  • CAS Registry: 91-56-5
  • KEGG: C11129
  • LipidMAPS:
  • BioCYC: ISATIN
6''-O-Acetyldaidzin

Formula: C23H22O10
Exact Mass: 458.1213
Source ID: CNP0208751.1
  • CAS Registry: 71385-83-6
  • KEGG:
  • LipidMAPS: LMPK12050015
  • BioCYC:
(+)-Linalool

Formula: C10H18O
Exact Mass: 154.1358
Source ID: CNP0373115.2
  • CAS Registry: 126-90-9
  • KEGG: C11389
  • LipidMAPS:
  • BioCYC: CPD-8997
Hydrochloric acid

Formula: HCl
Exact Mass: 35.9767
Source ID: CNP0499610.0
  • CAS Registry: 7647-01-0
  • KEGG: C01327
  • LipidMAPS:
  • BioCYC: HCL
17alpha-Hydroxyprogesterone

Formula: C21H30O3
Exact Mass: 330.2195
Source ID: CNP0259281.1
  • CAS Registry: 68-96-2
  • KEGG: C01176
  • LipidMAPS: LMST02030161
  • BioCYC: 17-ALPHA-HYDROXYPROGESTERONE
p-Mentha-1,3,5,8-tetraene

Formula: C10H12
Exact Mass: 132.0939
Source ID: CNP0302429.0
  • CAS Registry: 1195-32-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tetrahydrocurcumin

Formula: C21H24O6
Exact Mass: 372.1573
Source ID: CNP0288229.0
  • CAS Registry: 36062-04-1
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-13315
Campestanol

Formula: C28H50O
Exact Mass: 402.3861
Source ID: CNP0189068.1
  • CAS Registry: 474-60-2
  • KEGG: C15787
  • LipidMAPS: LMST01030103
  • BioCYC: CPD-710
Pyrrole

Formula: C4H5N
Exact Mass: 67.0422
Source ID: CNP0578490.0
  • CAS Registry: 109-97-7
  • KEGG: C19907
  • LipidMAPS:
  • BioCYC: Pyrroles
N-Methyl-L-proline

Formula: C6H11NO2
Exact Mass: 129.079
Source ID: CNP0209638.2
  • CAS Registry: 475-11-6
  • KEGG: C22223
  • LipidMAPS:
  • BioCYC:
tricarballylic acid

Formula: C6H8O6
Exact Mass: 176.0321
Source ID: CNP0346076.0
  • CAS Registry: 99-14-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Homocysteine

Formula: C4H9NO2S
Exact Mass: 135.0354
Source ID: CNP0193002.1
  • CAS Registry: 454-29-5
  • KEGG: C05330
  • LipidMAPS:
  • BioCYC: CPD-25858
O-methoxycatechol-O-sulphate

Formula: C7H8O5S
Exact Mass: 204.0092
Source ID: CNP0345338.0
  • CAS Registry: 3233-59-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Acetyl-L-carnitine

Formula: C9H17NO4
Exact Mass: 203.1158
Source ID: CNP0515384.1
  • CAS Registry: 3040-38-8
  • KEGG:
  • LipidMAPS: LMFA07070050
  • BioCYC:
Trimethylamine N-oxide

Formula: C3H9NO
Exact Mass: 75.0684
Source ID: CNP0598895.0
  • CAS Registry: 1184-78-7
  • KEGG: C01104
  • LipidMAPS:
  • BioCYC: TRIMENTHLAMINE-N-O
Glycochenodeoxycholate

Formula: C26H43NO5
Exact Mass: 449.3141
Source ID: CNP0567109.1
  • CAS Registry: 640-79-9
  • KEGG: C05466
  • LipidMAPS: LMST05030008
  • BioCYC: GLYCOCHENODEOXYCHOLIC_ACID
Glycocholate

Formula: C26H43NO6
Exact Mass: 465.309
Source ID: CNP0272822.5
  • CAS Registry: 475-31-0
  • KEGG: C01921
  • LipidMAPS: LMST05030001
  • BioCYC: GLYCOCHOLIC_ACID
Taurochenodeoxycholate

Formula: C26H45NO6S
Exact Mass: 499.2967
Source ID: CNP0190418.2
  • CAS Registry: 516-35-8
  • KEGG: C05465
  • LipidMAPS: LMST05040005
  • BioCYC:
Taurocholate

Formula: C26H45NO7S
Exact Mass: 515.2917
Source ID: CNP0179190.1
  • CAS Registry: 81-24-3
  • KEGG: C05122
  • LipidMAPS: LMST05040001
  • BioCYC:
Salicyluric acid

Formula: C9H9NO4
Exact Mass: 195.0532
Source ID: CNP0159089.0
  • CAS Registry: 487-54-7
  • KEGG: C07588
  • LipidMAPS:
  • BioCYC:
p-Cresol sulfate

Formula: C7H8O4S
Exact Mass: 188.0143
Source ID: CNP0393410.0
  • CAS Registry: 3233-58-7
  • KEGG: C06677
  • LipidMAPS:
  • BioCYC:
p-Cresol glucuronide

Formula: C13H16O7
Exact Mass: 284.0896
Source ID: CNP0252872.1
  • CAS Registry: 17680-99-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Phenylpropionylglycine

Formula: C11H13NO3
Exact Mass: 207.0895
Source ID: CNP0257200.0
  • CAS Registry: 56613-60-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N,N-Dimethylglycine

Formula: C4H9NO2
Exact Mass: 103.0633
Source ID: CNP0175140.0
  • CAS Registry: 1118-68-9
  • KEGG: C01026
  • LipidMAPS:
  • BioCYC: DIMETHYL-GLYCINE
5-Aminopentanoate

Formula: C5H11NO2
Exact Mass: 117.079
Source ID: CNP0167970.0
  • CAS Registry: 660-88-8
  • KEGG: C00431
  • LipidMAPS: LMFA01100040
  • BioCYC: 5-AMINOPENTANOATE
D-Alanyl-D-alanine

Formula: C6H12N2O3
Exact Mass: 160.0848
Source ID: CNP0191496.1
  • CAS Registry: 923-16-0
  • KEGG: C00993
  • LipidMAPS:
  • BioCYC: D-ALA-D-ALA
I-Urobilinogen

Formula: C33H44N4O6
Exact Mass: 592.3261
Source ID: CNP0156645.0
  • CAS Registry: 14684-37-8
  • KEGG: C05790
  • LipidMAPS:
  • BioCYC:
5-Hydroxy-L-tryptophan

Formula: C11H12N2O3
Exact Mass: 220.0848
Source ID: CNP0403850.1
  • CAS Registry: 4350-09-8
  • KEGG: C00643
  • LipidMAPS:
  • BioCYC: 5-HYDROXY-TRYPTOPHAN
(S)-2-Hydroxyglutarate

Formula: C5H8O5
Exact Mass: 148.0372
Source ID: CNP0156996.2
  • CAS Registry: 13095-48-2
  • KEGG: C03196
  • LipidMAPS:
  • BioCYC: CPD-381
7alpha-Hydroxy-3-oxo-5beta-cholan-24-oic acid

Formula: C24H38O4
Exact Mass: 390.277
Source ID: CNP0091894.1
  • CAS Registry: 4185-00-6
  • KEGG:
  • LipidMAPS: LMST04010161
  • BioCYC:
3-Pyridylacetic acid

Formula: C7H7NO2
Exact Mass: 137.0477
Source ID: CNP0105682.0
  • CAS Registry: 501-81-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
beta-D-Ribofuranose

Formula: C5H10O5
Exact Mass: 150.0528
Source ID: CNP0357953.2
  • CAS Registry: 15761-67-8
  • KEGG: C16639
  • LipidMAPS:
  • BioCYC:
Methylimidazoleacetic acid

Formula: C6H8N2O2
Exact Mass: 140.0586
Source ID: CNP0033258.0
  • CAS Registry: 2625-49-2
  • KEGG: C05828
  • LipidMAPS:
  • BioCYC:
Isochenodeoxycholate

Formula: C24H40O4
Exact Mass: 392.2926
Source ID: CNP0224402.6
  • CAS Registry: 566-24-5
  • KEGG: C17660
  • LipidMAPS: LMST04010034
  • BioCYC:
Isolithocholate

Formula: C24H40O3
Exact Mass: 376.2977
Source ID: CNP0202730.4
  • CAS Registry: 1534-35-6
  • KEGG: C17658
  • LipidMAPS: LMST04010004
  • BioCYC:
Isoursodeoxycholate

Formula: C24H40O4
Exact Mass: 392.2926
Source ID: CNP0224402.7
  • CAS Registry: 78919-26-3
  • KEGG: C17662
  • LipidMAPS: LMST04010035
  • BioCYC:
Cholic acid

Formula: C24H40O5
Exact Mass: 408.2876
Source ID: CNP0347795.2
  • CAS Registry: 81-25-4
  • KEGG: C00695
  • LipidMAPS: LMST04010001
  • BioCYC: CHOLATE
2-Hydroxyestrone

Formula: C18H22O3
Exact Mass: 286.1569
Source ID: CNP0178555.1
  • CAS Registry: 362-06-1
  • KEGG: C05298
  • LipidMAPS: LMST02010032
  • BioCYC:
Aryl sulfate

Formula: C6H6O4S
Exact Mass: 173.9987
Source ID: CNP0567034.0
  • CAS Registry: 937-34-8
  • KEGG: C00850
  • LipidMAPS:
  • BioCYC:
Ensorb

Formula: C59H90O4
Exact Mass: 862.6839
Source ID: CNP0278913.0
  • CAS Registry: 27696-12-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Trimethylammoniobutanoic acid

Formula: C7H15NO2
Exact Mass: 145.1103
Source ID: CNP0082937.0
  • CAS Registry: 407-64-7
  • KEGG: C01181
  • LipidMAPS:
  • BioCYC:
1,3-Diaminopropane

Formula: C3H10N2
Exact Mass: 74.0844
Source ID: CNP0566837.0
  • CAS Registry: 109-76-2
  • KEGG: C00986
  • LipidMAPS:
  • BioCYC: CPD-313
16alpha-Hydroxyestrone

Formula: C18H22O3
Exact Mass: 286.1569
Source ID: CNP0163379.1
  • CAS Registry: 566-76-7
  • KEGG: C05300
  • LipidMAPS: LMST02010041
  • BioCYC:
Leucylproline

Formula: C11H20N2O3
Exact Mass: 228.1474
Source ID: CNP0079795.1
  • CAS Registry: 6403-35-6
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-23025
Succinyladenosine

Formula: C14H17N5O8
Exact Mass: 383.1077
Source ID: CNP0105148.1
  • CAS Registry: 4542-23-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Oxobutanoate

Formula: C4H6O3
Exact Mass: 102.0317
Source ID: CNP0283357.0
  • CAS Registry: 600-18-0
  • KEGG: C00109
  • LipidMAPS: LMFA01060002
  • BioCYC: 2-OXOBUTANOATE
3-Methoxytyramine

Formula: C9H13NO2
Exact Mass: 167.0946
Source ID: CNP0308219.0
  • CAS Registry: 554-52-9
  • KEGG: C05587
  • LipidMAPS:
  • BioCYC:
Acetylglycine

Formula: C4H7NO3
Exact Mass: 117.0426
Source ID: CNP0232085.0
  • CAS Registry: 543-24-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Methylhistamine dihydrochloride

Formula: C6H11N3
Exact Mass: 125.0953
Source ID: CNP0415799.0
  • CAS Registry: 501-75-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N1-Acetylspermidine

Formula: C9H21N3O
Exact Mass: 187.1685
Source ID: CNP0155123.0
  • CAS Registry: 14278-49-0
  • KEGG: C00612
  • LipidMAPS:
  • BioCYC: CPD-568
Vanilpyruvic acid

Formula: C10H10O5
Exact Mass: 210.0528
Source ID: CNP0182576.0
  • CAS Registry: 1081-71-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Hydroxymethyluracil

Formula: C5H6N2O3
Exact Mass: 142.0378
Source ID: CNP0562105.0
  • CAS Registry: 4433-40-3
  • KEGG: C03088
  • LipidMAPS:
  • BioCYC: CPD-254
2-Hydroxydecanedioic acid

Formula: C10H18O5
Exact Mass: 218.1154
Source ID: CNP0418971.0
  • CAS Registry: 103963-71-9
  • KEGG:
  • LipidMAPS: LMFA01170076
  • BioCYC:
2'-Hydroxyacetanilide

Formula: C8H9NO2
Exact Mass: 151.0633
Source ID: CNP0144383.0
  • CAS Registry: 614-80-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-methylhept-3-ene

Formula: C8H16
Exact Mass: 112.1252
Source ID: CNP0345457.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C8H16
Exact Mass: 112.1252
Source ID: CNP0084706.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-isopropyl-5-methyl-1-heptanol

Formula: C11H24O
Exact Mass: 172.1827
Source ID: CNP0350619.0
  • CAS Registry: 91337-07-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-methyl-1,3-thiazolidine-2-carboxamide

Formula: C5H10N2OS
Exact Mass: 146.0514
Source ID: CNP0304038.0
  • CAS Registry: 13084-22-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethoxy-hydroxyphosphoryl] phosphono phosphate

Formula: C12H19N4O10P3S
Exact Mass: 504.0035
Source ID: CNP0570884.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Carbamoyl phosphate

Formula: CH4NO5P
Exact Mass: 140.9827
Source ID: CNP0209834.0
  • CAS Registry: 590-55-6
  • KEGG: C00169
  • LipidMAPS:
  • BioCYC:
2,2-dimethyl-3,6,9,12,15-pentaoxa-2-silahexadecane

Formula: C12H28O5Si
Exact Mass: 280.1706
Source ID: CNP0399781.0
  • CAS Registry: 78463-25-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Hydroxy-5-(dihydroxyphenyl)-valeric acid-O-methyl-O-sulphate

Formula: C12H16O9S
Exact Mass: 336.0515
Source ID: CNP0145588.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-4'-O-sulphate

Formula: C11H12O8S
Exact Mass: 304.0253
Source ID: CNP0128194.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
LPC 20:5

Formula: C28H48NO7P
Exact Mass: 541.3168
Source ID: CNP0542160.1
  • CAS Registry: 162440-04-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
methylheptenene

Formula: C8H14
Exact Mass: 110.1095
Source ID: CNP0275494.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tetrahydro-2,5-dimethyl-2H-pyranmethanol

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0084724.0
  • CAS Registry: 54004-46-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(22:4(7Z,10Z,13Z,16Z)/P-16:0)

Formula: C46H84NO7P
Exact Mass: 793.5985
Source ID: CNP0571245.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
3,5-Dimethylcyclohexanol

Formula: C8H16O
Exact Mass: 128.1201
Source ID: CNP0084709.0
  • CAS Registry: 5441-52-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(22:2(13Z,16Z)/P-18:1(11Z))

Formula: C48H90NO7P
Exact Mass: 823.6455
Source ID: CNP0530686.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:3(8Z,11Z,14Z)/P-16:0)

Formula: C44H82NO7P
Exact Mass: 767.5829
Source ID: CNP0574547.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:3(8Z,11Z,14Z)/P-18:0)

Formula: C46H86NO7P
Exact Mass: 795.6142
Source ID: CNP0478963.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:3(8Z,11Z,14Z)/P-18:1(11Z))

Formula: C46H84NO7P
Exact Mass: 793.5985
Source ID: CNP0593581.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:4(5Z,8Z,11Z,14Z)/P-16:0)

Formula: C44H80NO7P
Exact Mass: 765.5672
Source ID: CNP0483173.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
2-ethyl-3-hydroxybutyric acid

Formula: C6H12O3
Exact Mass: 132.0786
Source ID: CNP0376604.0
  • CAS Registry: 854851-58-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pentane-2,4-dione

Formula: C5H8O2
Exact Mass: 100.0524
Source ID: CNP0344390.0
  • CAS Registry: 123-54-6
  • KEGG: C15499
  • LipidMAPS: LMFA12000075
  • BioCYC: CPD-8879
PC(16:1(9Z)/P-18:1(9Z))

Formula: C42H80NO7P
Exact Mass: 741.5672
Source ID: CNP0525375.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:1(11Z)/P-16:0)

Formula: C42H82NO7P
Exact Mass: 743.5829
Source ID: CNP0496934.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:1(11Z)/P-18:1(11Z))

Formula: C44H84NO7P
Exact Mass: 769.5985
Source ID: CNP0564256.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:1(11Z)/P-18:1(9Z))

Formula: C44H84NO7P
Exact Mass: 769.5985
Source ID: CNP0597222.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
Methylthiopropene

Formula: C4H8S
Exact Mass: 88.0347
Source ID: CNP0587371.0
  • CAS Registry: 10152-77-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
TG(16:0/16:0/18:1(9Z))

Formula: C53H100O6
Exact Mass: 832.752
Source ID: CNP0265624.1
  • CAS Registry:
  • KEGG: C00422
  • LipidMAPS: LMGL03010006
  • BioCYC: Triacylglycerols
Glycerone

Formula: C3H6O3
Exact Mass: 90.0317
Source ID: CNP0303926.0
  • CAS Registry: 96-26-4
  • KEGG: C00184
  • LipidMAPS:
  • BioCYC: DIHYDROXYACETONE
6-iminohexane-1,2,3,4,5-pentol

Formula: C6H13NO5
Exact Mass: 179.0794
Source ID: CNP0372810.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Glyoxime

Formula: C2H4N2O2
Exact Mass: 88.0273
Source ID: CNP0213631.0
  • CAS Registry: 557-30-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/P-16:0)

Formula: C46H80NO7P
Exact Mass: 789.5672
Source ID: CNP0542034.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
Methylpyrogallol sulfate 3

Formula: C7H8O6S
Exact Mass: 220.0042
Source ID: CNP0164237.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
C16-Ceramide

Formula: C34H67NO3
Exact Mass: 537.5121
Source ID: CNP0152332.1
  • CAS Registry: 24696-26-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(P-18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z))

Formula: C46H80NO7P
Exact Mass: 789.5672
Source ID: CNP0487781.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Lanthionine ketimine

Formula: C6H7NO4S
Exact Mass: 189.0096
Source ID: CNP0288509.0
  • CAS Registry: 83923-11-9
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-16728
PC(24:0/P-18:1(9Z))

Formula: C50H98NO7P
Exact Mass: 855.7081
Source ID: CNP0567857.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(P-18:1(9Z)/14:0)

Formula: C40H78NO7P
Exact Mass: 715.5516
Source ID: CNP0498012.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMGP01030143
  • BioCYC:
PC(18:3(6Z,9Z,12Z)/P-16:0)

Formula: C42H78NO7P
Exact Mass: 739.5516
Source ID: CNP0580333.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:3(6Z,9Z,12Z)/P-18:0)

Formula: C44H82NO7P
Exact Mass: 767.5829
Source ID: CNP0517037.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:3(6Z,9Z,12Z)/P-18:1(9Z))

Formula: C44H80NO7P
Exact Mass: 765.5672
Source ID: CNP0579219.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:2(9Z,12Z)/P-18:0)

Formula: C44H84NO7P
Exact Mass: 769.5985
Source ID: CNP0605150.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
3-methylmalic acid

Formula: C5H8O5
Exact Mass: 148.0372
Source ID: CNP0389403.0
  • CAS Registry: 608-41-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C11H22
Exact Mass: 154.1721
Source ID: CNP0147977.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,6-dimethyloct-3-ene

Formula: C10H20
Exact Mass: 140.1565
Source ID: CNP0083062.0
  • CAS Registry: 6874-28-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3,7-Dimethyl-3-octanol

Formula: C10H22O
Exact Mass: 158.1671
Source ID: CNP0083056.0
  • CAS Registry: 78-69-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-Acetyltaurine

Formula: C4H9NO4S
Exact Mass: 167.0252
Source ID: CNP0083041.0
  • CAS Registry: 19213-70-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Hexenoylcarnitine

Formula: C13H23NO4
Exact Mass: 257.1627
Source ID: CNP0478983.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMFA07070031
  • BioCYC:
mono(2-ethyl-5-hydroxyhexyl) phthalate

Formula: C16H22O5
Exact Mass: 294.1467
Source ID: CNP0081922.0
  • CAS Registry: 40321-99-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
D-Urobilin

Formula: C33H40N4O6
Exact Mass: 588.2948
Source ID: CNP0093778.0
  • CAS Registry: 3947-38-4
  • KEGG: C05795
  • LipidMAPS:
  • BioCYC:
ethylene glycol monophosphate

Formula: C2H7O5P
Exact Mass: 142.0031
Source ID: CNP0082124.0
  • CAS Registry: 1892-26-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,6-octadiene

Formula: C8H14
Exact Mass: 110.1095
Source ID: CNP0082120.0
  • CAS Registry: 4974-27-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-cyclopentylethanol

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0082077.0
  • CAS Registry: 52829-98-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(16:0/P-18:1(11Z))

Formula: C42H82NO7P
Exact Mass: 743.5829
Source ID: CNP0497105.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(16:0/P-18:1(9Z))

Formula: C42H82NO7P
Exact Mass: 743.5829
Source ID: CNP0496460.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE


Formula: C11H12O8S
Exact Mass: 304.0253
Source ID: CNP0084258.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(14:0/P-18:1(11Z))

Formula: C40H78NO7P
Exact Mass: 715.5516
Source ID: CNP0503170.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(14:0/P-18:0)

Formula: C40H80NO7P
Exact Mass: 717.5672
Source ID: CNP0572558.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:1(9Z)/P-16:0)

Formula: C42H82NO7P
Exact Mass: 743.5829
Source ID: CNP0583554.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:1(9Z)/P-18:0)

Formula: C44H86NO7P
Exact Mass: 771.6142
Source ID: CNP0572566.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
Methylgallic acid-O-sulphate

Formula: C8H8O8S
Exact Mass: 263.994
Source ID: CNP0084217.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(16:1(9Z)/P-18:1(11Z))

Formula: C42H80NO7P
Exact Mass: 741.5672
Source ID: CNP0514057.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(16:1(9Z)/P-16:0)

Formula: C40H78NO7P
Exact Mass: 715.5516
Source ID: CNP0580601.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:1(11Z))

Formula: C46H80NO7P
Exact Mass: 789.5672
Source ID: CNP0577319.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:0)

Formula: C46H82NO7P
Exact Mass: 791.5829
Source ID: CNP0594776.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:1(11Z)/P-16:0)

Formula: C44H86NO7P
Exact Mass: 771.6142
Source ID: CNP0566235.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:4(5Z,8Z,11Z,14Z)/P-18:1(9Z))

Formula: C46H82NO7P
Exact Mass: 791.5829
Source ID: CNP0580552.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
TG(18:2(9Z,12Z)/18:3(9Z,12Z,15Z)/18:0)

Formula: C57H100O6
Exact Mass: 880.752
Source ID: CNP0355718.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(20:4(8Z,11Z,14Z,17Z)/P-16:0)

Formula: C44H80NO7P
Exact Mass: 765.5672
Source ID: CNP0567655.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PD119946

Formula: C53H98O6
Exact Mass: 830.7363
Source ID: CNP0287041.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C53H98O6
Exact Mass: 830.7363
Source ID: CNP0084634.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Carboxy-1-hydroxypropyl-ThPP

Formula: C16H25N4O10P2S
Exact Mass: 527.0767
Source ID: CNP0228314.0
  • CAS Registry:
  • KEGG: C05381
  • LipidMAPS:
  • BioCYC:
20alpha-Hydroxycholesterol

Formula: C27H46O2
Exact Mass: 402.3498
Source ID: CNP0347064.1
  • CAS Registry: 516-72-3
  • KEGG: C05500
  • LipidMAPS: LMST01010201
  • BioCYC: 2-HYDROXY-CHOLESTEROL
3-Sulfinylpyruvate

Formula: C3H4O5S
Exact Mass: 151.9779
Source ID: CNP0083680.0
  • CAS Registry: 88947-38-0
  • KEGG: C05527
  • LipidMAPS:
  • BioCYC:
2,3-Bisphospho-D-glycerate

Formula: C3H8O10P2
Exact Mass: 265.9593
Source ID: CNP0221489.1
  • CAS Registry: 14438-19-8
  • KEGG: C01159
  • LipidMAPS:
  • BioCYC: 23-DIPHOSPHOGLYCERATE
2-Ethylglutaric acid

Formula: C7H12O4
Exact Mass: 160.0736
Source ID: CNP0084072.0
  • CAS Registry: 617-26-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(P-18:1(11Z)/20:3(5Z,8Z,11Z))

Formula: C46H84NO7P
Exact Mass: 793.5985
Source ID: CNP0593374.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(P-18:1(11Z)/16:0)

Formula: C42H82NO7P
Exact Mass: 743.5829
Source ID: CNP0593801.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMGP01030134
  • BioCYC:
PC(P-18:1(11Z)/18:3(9Z,12Z,15Z))

Formula: C44H80NO7P
Exact Mass: 765.5672
Source ID: CNP0586237.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(P-18:0/20:4(8Z,11Z,14Z,17Z))

Formula: C46H84NO7P
Exact Mass: 793.5985
Source ID: CNP0525066.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(P-18:0/18:3(9Z,12Z,15Z))

Formula: C44H82NO7P
Exact Mass: 767.5829
Source ID: CNP0517576.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMGP01030060
  • BioCYC:
PC(P-16:0/20:3(8Z,11Z,14Z))

Formula: C44H82NO7P
Exact Mass: 767.5829
Source ID: CNP0498409.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Protoporphyrinogen IX

Formula: C34H40N4O4
Exact Mass: 568.3049
Source ID: CNP0085587.0
  • CAS Registry: 7412-77-3
  • KEGG: C01079
  • LipidMAPS:
  • BioCYC:
Arsenobetaine

Formula: C5H11AsO2
Exact Mass: 177.9975
Source ID: CNP0085594.0
  • CAS Registry: 64436-13-1
  • KEGG: C19331
  • LipidMAPS:
  • BioCYC: CPD-23517
Portulacaxanthin II

Formula: C18H18N2O7
Exact Mass: 374.1114
Source ID: CNP0372100.1
  • CAS Registry: 135545-98-1
  • KEGG: C08565
  • LipidMAPS:
  • BioCYC: CPD-8670
2-Aminomuconate

Formula: C6H7NO4
Exact Mass: 157.0375
Source ID: CNP0360097.0
  • CAS Registry: 4548-99-6
  • KEGG: C02220
  • LipidMAPS: LMFA01170082
  • BioCYC:
TG(16:0/18:0/20:4(5Z,8Z,11Z,14Z))

Formula: C57H102O6
Exact Mass: 882.7676
Source ID: CNP0174528.1
  • CAS Registry: 72120-34-4
  • KEGG: C00422
  • LipidMAPS:
  • BioCYC: Triacylglycerols
4-Fumarylacetoacetate

Formula: C8H8O6
Exact Mass: 200.0321
Source ID: CNP0335134.0
  • CAS Registry: 28613-33-4
  • KEGG: C01061
  • LipidMAPS: LMFA01170066
  • BioCYC:
LPC 16:1

Formula: C24H48NO7P
Exact Mass: 493.3168
Source ID: CNP0518032.1
  • CAS Registry: 76790-27-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
DG(18:0/18:2(9Z,12Z)/0:0)

Formula: C39H72O5
Exact Mass: 620.5379
Source ID: CNP0346939.1
  • CAS Registry: 34487-26-8
  • KEGG:
  • LipidMAPS: LMGL02010050
  • BioCYC:
DG 18:2(9Z,12Z)/18:2(9Z,12Z)/0:0

Formula: C39H68O5
Exact Mass: 616.5066
Source ID: CNP0171209.1
  • CAS Registry: 24529-89-3
  • KEGG:
  • LipidMAPS: LMGL02010063
  • BioCYC:
LysoPC(0:0/18:1(9Z))

Formula: C26H52NO7P
Exact Mass: 521.3481
Source ID: CNP0581856.1
  • CAS Registry: 22248-65-3
  • KEGG:
  • LipidMAPS: LMGP01050082
  • BioCYC:
Phosphodimethylethanolamine

Formula: C4H12NO4P
Exact Mass: 169.0504
Source ID: CNP0082860.0
  • CAS Registry: 6909-62-2
  • KEGG: C13482
  • LipidMAPS:
  • BioCYC:
3-Oxopropanoate

Formula: C3H4O3
Exact Mass: 88.016
Source ID: CNP0149091.0
  • CAS Registry: 926-61-4
  • KEGG: C00222
  • LipidMAPS:
  • BioCYC:
4-Nitrophenyl sulfate

Formula: C6H5NO6S
Exact Mass: 218.9838
Source ID: CNP0487125.0
  • CAS Registry: 1080-04-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Aminoisobutyric acid

Formula: C4H9NO2
Exact Mass: 103.0633
Source ID: CNP0291505.1
  • CAS Registry: 144-90-1
  • KEGG: C05145
  • LipidMAPS: LMFA01100054
  • BioCYC: 3-AMINO-ISOBUTYRATE
Debrisoquin

Formula: C10H13N3
Exact Mass: 175.1109
Source ID: CNP0289053.0
  • CAS Registry: 1131-64-2
  • KEGG: C13650
  • LipidMAPS:
  • BioCYC:
2,3-Diketo-5-methylthiopentyl-1-phosphate

Formula: C6H11O6PS
Exact Mass: 242.0014
Source ID: CNP0158492.0
  • CAS Registry: 115974-73-7
  • KEGG: C15650
  • LipidMAPS:
  • BioCYC:
NADPH

Formula: C21H30N7O17P3
Exact Mass: 745.0911
Source ID: CNP0265401.1
  • CAS Registry: 2646-71-1
  • KEGG: C00005
  • LipidMAPS:
  • BioCYC:
2-isopropylaminoethylamine

Formula: C5H14N2
Exact Mass: 102.1157
Source ID: CNP0082470.0
  • CAS Registry: 19522-67-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4,7,10,13,16-Docosapentaenoic acid

Formula: C22H34O2
Exact Mass: 330.2559
Source ID: CNP0199188.0
  • CAS Registry: 2313-14-6
  • KEGG:
  • LipidMAPS: LMFA01030182
  • BioCYC:
Vernolepin

Formula: C15H16O5
Exact Mass: 276.0998
Source ID: CNP0177905.0
  • CAS Registry: 18542-37-5
  • KEGG: C09582
  • LipidMAPS:
  • BioCYC:
bis(trimethylsilyl)isovanillate

Formula: C14H24O4Si2
Exact Mass: 312.1213
Source ID: CNP0135073.0
  • CAS Registry: 68595-68-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C31H40O3
Exact Mass: 460.2977
Source ID: CNP0082228.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3,7-Dimethylocta-2,6-dienyl dihydrogen phosphate

Formula: C10H19O4P
Exact Mass: 234.1021
Source ID: CNP0419716.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(E)-2-Octene

Formula: C8H16
Exact Mass: 112.1252
Source ID: CNP0199237.0
  • CAS Registry: 111-67-1
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-23213
2,6,8-Trimethyldecane

Formula: C13H28
Exact Mass: 184.2191
Source ID: CNP0084727.0
  • CAS Registry: 62108-26-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Valero-1,5-lactam

Formula: C8H17NOSi
Exact Mass: 171.1079
Source ID: CNP0251834.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methyl-1-heptene

Formula: C8H16
Exact Mass: 112.1252
Source ID: CNP0354372.0
  • CAS Registry: 4810-09-7
  • KEGG:
  • LipidMAPS: LMFA11000592
  • BioCYC:
3-Methylhexanal

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0405888.0
  • CAS Registry: 19269-28-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3,6-Dimethyloctane-3,6-diol

Formula: C10H22O2
Exact Mass: 174.162
Source ID: CNP0377557.0
  • CAS Registry: 78-65-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
cis-3-Hexenyl salicylate

Formula: C13H16O3
Exact Mass: 220.1099
Source ID: CNP0084845.0
  • CAS Registry: 65405-77-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(20:4(5Z,8Z,11Z,14Z)/P-18:0)

Formula: C46H84NO7P
Exact Mass: 793.5985
Source ID: CNP0578900.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
3-octene

Formula: C8H16
Exact Mass: 112.1252
Source ID: CNP0084702.0
  • CAS Registry: 592-98-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3,4-Dimethylcyclohexanol

Formula: C8H16O
Exact Mass: 128.1201
Source ID: CNP0084708.0
  • CAS Registry: 5715-23-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(22:2(13Z,16Z)/P-18:1(9Z))

Formula: C48H90NO7P
Exact Mass: 823.6455
Source ID: CNP0572497.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:4(5Z,8Z,11Z,14Z)/P-18:1(11Z))

Formula: C46H82NO7P
Exact Mass: 791.5829
Source ID: CNP0508705.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
3-Methyleneheptane

Formula: C8H16
Exact Mass: 112.1252
Source ID: CNP0084703.0
  • CAS Registry: 1632-16-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(20:3(8Z,11Z,14Z)/P-18:1(9Z))

Formula: C46H84NO7P
Exact Mass: 793.5985
Source ID: CNP0537905.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE


Formula: C53H94O6
Exact Mass: 826.705
Source ID: CNP0199488.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
diethylcarbamothioyl-methyl-oxidosulfanium

Formula: C6H13NOS2
Exact Mass: 179.0439
Source ID: CNP0593518.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-methylcyclohexanone

Formula: C7H12O
Exact Mass: 112.0888
Source ID: CNP0263169.0
  • CAS Registry: 24965-87-5
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-23641
Isolongifolene, 4,5,9,10-dehydro-

Formula: C15H20
Exact Mass: 200.1565
Source ID: CNP0084192.0
  • CAS Registry: 156747-45-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Hydroxy-2-pentanone

Formula: C5H10O2
Exact Mass: 102.0681
Source ID: CNP0084314.0
  • CAS Registry: 64502-89-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(18:0/P-18:1(11Z))

Formula: C44H86NO7P
Exact Mass: 771.6142
Source ID: CNP0503000.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:1(11Z)/P-18:0)

Formula: C44H86NO7P
Exact Mass: 771.6142
Source ID: CNP0482081.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
Tetradecan-2-ol

Formula: C14H30O
Exact Mass: 214.2297
Source ID: CNP0214390.0
  • CAS Registry: 4706-81-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(18:0/P-18:1(9Z))

Formula: C44H86NO7P
Exact Mass: 771.6142
Source ID: CNP0568976.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
DEC-4-ENEDIOIC ACID

Formula: C10H16O4
Exact Mass: 200.1049
Source ID: CNP0138278.0
  • CAS Registry: 72879-22-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Solerol

Formula: C6H10O4
Exact Mass: 146.0579
Source ID: CNP0245181.0
  • CAS Registry: 27610-27-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
6-(2-amino-2-carboxyethyl)-4-hydroxybenzothiazole

Formula: C10H10N2O3S
Exact Mass: 238.0412
Source ID: CNP0082465.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-(4-methyl-1-piperazinyl)ethanamine

Formula: C7H17N3
Exact Mass: 143.1422
Source ID: CNP0190807.0
  • CAS Registry: 934-98-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-methoxy-3-methylhexane

Formula: C8H18O
Exact Mass: 130.1358
Source ID: CNP0082474.0
  • CAS Registry: 74630-91-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
7-(2-amino-2-carboxyethyl)-5-hydroxy-3,4-dihydro-2H-1,4-benzothiazin-3-one

Formula: C11H12N2O4S
Exact Mass: 268.0518
Source ID: CNP0082464.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PS(18:0/18:0)

Formula: C42H82NO10P
Exact Mass: 791.5676
Source ID: CNP0234076.1
  • CAS Registry: 1446756-47-3
  • KEGG:
  • LipidMAPS: LMGP03010036
  • BioCYC:
Ethyl pentanoate

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0305309.0
  • CAS Registry: 539-82-2
  • KEGG:
  • LipidMAPS: LMFA07010881
  • BioCYC:
Nicotinamide-beta-riboside

Formula: C11H15N2O5
Exact Mass: 255.0981
Source ID: CNP0605187.1
  • CAS Registry: 1341-23-7
  • KEGG: C03150
  • LipidMAPS:
  • BioCYC: NICOTINAMIDE_RIBOSE
2-dehydro-L-gluconic acid

Formula: C6H10O7
Exact Mass: 194.0427
Source ID: CNP0184376.3
  • CAS Registry: 29123-55-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-hydroxyacrylic Acid

Formula: C3H4O3
Exact Mass: 88.016
Source ID: CNP0422136.0
  • CAS Registry: 35326-33-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-(3,4,5,6-tetrahydroxy-1-iminohexan-2-yl)acetamide

Formula: C8H16N2O5
Exact Mass: 220.1059
Source ID: CNP0082055.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4-Dihydroxybutanoic acid

Formula: C4H8O4
Exact Mass: 120.0423
Source ID: CNP0218005.0
  • CAS Registry: 1518-62-3
  • KEGG:
  • LipidMAPS: LMFA01050385
  • BioCYC:
2-Methyl-3-ketovaleric acid

Formula: C6H10O3
Exact Mass: 130.063
Source ID: CNP0082310.0
  • CAS Registry: 14925-93-0
  • KEGG:
  • LipidMAPS: LMFA01060192
  • BioCYC:
2-Methylbutyrylglycine

Formula: C7H13NO3
Exact Mass: 159.0895
Source ID: CNP0082309.0
  • CAS Registry: 52320-67-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-amino-4-(cyclohex-3-en-1-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile

Formula: C18H22N2O2
Exact Mass: 298.1681
Source ID: CNP0221649.0
  • CAS Registry: 275360-55-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-phenyl-1,2-propanediol

Formula: C9H12O2
Exact Mass: 152.0837
Source ID: CNP0122921.0
  • CAS Registry: 4217-66-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-nonyn-3-ol

Formula: C9H16O
Exact Mass: 140.1201
Source ID: CNP0082068.0
  • CAS Registry: 53723-19-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C8H16N2O6
Exact Mass: 236.1008
Source ID: CNP0082066.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-hydroxy-2,2-dimethylbutyric acid

Formula: C6H12O3
Exact Mass: 132.0786
Source ID: CNP0082064.0
  • CAS Registry: 29269-83-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-methyl-1,2-butanediol

Formula: C5H12O2
Exact Mass: 104.0837
Source ID: CNP0308368.0
  • CAS Registry: 41051-72-3
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-19060
3-hydroxy-3-butenoic acid

Formula: C4H6O3
Exact Mass: 102.0317
Source ID: CNP0082070.0
  • CAS Registry: 180713-85-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-methylhexan-2-one oxime

Formula: C7H15NO
Exact Mass: 129.1154
Source ID: CNP0165038.0
  • CAS Registry: 624-44-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C21H36O4
Exact Mass: 352.2613
Source ID: CNP0180628.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2Z)-2-(N-HYDROXYIMINO)-3-PHENYLPROPANOIC ACID

Formula: C9H9NO3
Exact Mass: 179.0582
Source ID: CNP0272865.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-(hydroxyimino)-4-methylpentanoic acid

Formula: C6H11NO3
Exact Mass: 145.0739
Source ID: CNP0082072.0
  • CAS Registry: 76617-78-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-hydroxy decenedioic acid

Formula: C10H16O5
Exact Mass: 216.0998
Source ID: CNP0183398.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-(methoxyimino)-3-methylbutanoic acid

Formula: C6H11NO3
Exact Mass: 145.0739
Source ID: CNP0082065.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-(2-methylenecyclopropyl)ethanone

Formula: C6H8O
Exact Mass: 96.0575
Source ID: CNP0082059.0
  • CAS Registry: 62266-35-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-hydroxyphenylpyruvic acid oxime

Formula: C9H9NO4
Exact Mass: 195.0532
Source ID: CNP0341137.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
L-Bornesitol

Formula: C7H14O6
Exact Mass: 194.079
Source ID: CNP0082057.0
  • CAS Registry:
  • KEGG: C03660
  • LipidMAPS:
  • BioCYC: CPD-1701


Formula: C4H9NO3
Exact Mass: 119.0582
Source ID: CNP0082054.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-(3-hydroxyphenyl)propionic acid

Formula: C9H10O3
Exact Mass: 166.063
Source ID: CNP0140626.0
  • CAS Registry: 56911-50-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-methylidene-2-(pent-4-en-1-yl)cyclopropane

Formula: C9H14
Exact Mass: 122.1095
Source ID: CNP0302081.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C20H30O2
Exact Mass: 302.2246
Source ID: CNP0081963.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C23H38O5
Exact Mass: 394.2719
Source ID: CNP0081986.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Decene

Formula: C10H20
Exact Mass: 140.1565
Source ID: CNP0223572.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Methyl-2-methylene-1-(1methylethylidene)-cyclohexane

Formula: C11H18
Exact Mass: 150.1408
Source ID: CNP0084860.0
  • CAS Registry: 56763-62-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5C-aglycone

Formula: C16H16O4
Exact Mass: 272.1049
Source ID: CNP0137170.0
  • CAS Registry: 34927-45-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(18:3(6Z,9Z,12Z)/P-18:1(11Z))

Formula: C44H80NO7P
Exact Mass: 765.5672
Source ID: CNP0541518.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
1-(4-bromobutyl)-2-piperidinone

Formula: C9H16BrNO
Exact Mass: 233.0415
Source ID: CNP0215527.0
  • CAS Registry: 195194-80-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Putreanine

Formula: C7H16N2O2
Exact Mass: 160.1212
Source ID: CNP0200835.0
  • CAS Registry: 25887-39-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isoleucine

Formula: C6H13NO2
Exact Mass: 131.0946
Source ID: CNP0084337.0
  • CAS Registry: 443-79-8
  • KEGG: C16434
  • LipidMAPS:
  • BioCYC:
ICX5609030

Formula: C20H26O2
Exact Mass: 298.1933
Source ID: CNP0207249.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Benzylalcohol alpha-isobutyl-2,4,6-trimethyl(1-mestyl-3-methyl-1-butanol)

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0084310.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(18:2(9Z,12Z)/P-18:1(11Z))

Formula: C44H82NO7P
Exact Mass: 767.5829
Source ID: CNP0505178.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(24:0/P-18:1(11Z))

Formula: C50H98NO7P
Exact Mass: 855.7081
Source ID: CNP0573161.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:2(9Z,12Z)/P-18:1(9Z))

Formula: C44H82NO7P
Exact Mass: 767.5829
Source ID: CNP0580830.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
5-(3',5'-Dihydroxyphenyl)-gamma-valerolactone-O-sulphate-O-methyl

Formula: C12H14O7S
Exact Mass: 302.046
Source ID: CNP0084270.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-hexacosanoylglycine

Formula: C28H55NO3
Exact Mass: 453.4182
Source ID: CNP0082287.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Geranyl acetoacetate

Formula: C14H22O3
Exact Mass: 238.1569
Source ID: CNP0083904.0
  • CAS Registry: 10032-00-5
  • KEGG:
  • LipidMAPS: LMFA07010896
  • BioCYC:
Ethionamide sulphoxide

Formula: C8H10N2OS
Exact Mass: 182.0514
Source ID: CNP0135338.0
  • CAS Registry: 536-28-7
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-19989
7C-aglycone

Formula: C18H18O4
Exact Mass: 298.1205
Source ID: CNP0083885.0
  • CAS Registry: 51732-61-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,6 Dimethylheptanoyl carnitine

Formula: C16H31NO4
Exact Mass: 301.2253
Source ID: CNP0479857.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMFA07070029
  • BioCYC:
1-ethyl-2-propylcyclohexane

Formula: C11H22
Exact Mass: 154.1721
Source ID: CNP0083068.0
  • CAS Registry: 62238-33-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4,4-trimethylpentane-1,3-diyl bis(2-methylpropanoate)

Formula: C16H30O4
Exact Mass: 286.2144
Source ID: CNP0084428.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4,6,8-trimethyl-1-nonene

Formula: C12H24
Exact Mass: 168.1878
Source ID: CNP0083066.0
  • CAS Registry: 54410-98-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,3,4-trimethyl-3-hexenal

Formula: C9H16O
Exact Mass: 140.1201
Source ID: CNP0410667.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2,3-diphenylcyclopropyl)methyl-oxido-phenylsulfanium

Formula: C22H20OS
Exact Mass: 332.1235
Source ID: CNP0580713.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
trichloro(docosyl)silane

Formula: C22H45Cl3Si
Exact Mass: 442.2356
Source ID: CNP0145083.0
  • CAS Registry: 7325-84-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3,5-dimethyloctane

Formula: C10H22
Exact Mass: 142.1721
Source ID: CNP0083059.0
  • CAS Registry: 15869-93-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-methyldec-1-ene

Formula: C11H22
Exact Mass: 154.1721
Source ID: CNP0083054.0
  • CAS Registry: 54244-79-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
dodecamethylpentasiloxane

Formula: C12H36O4Si5
Exact Mass: 384.146
Source ID: CNP0221455.0
  • CAS Registry: 141-63-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Methylnicotinamide

Formula: C7H9N2O
Exact Mass: 137.0715
Source ID: CNP0212015.0
  • CAS Registry: 3106-60-3
  • KEGG: C02918
  • LipidMAPS:
  • BioCYC: CPD-396
Dopaquinone

Formula: C9H9NO4
Exact Mass: 195.0532
Source ID: CNP0118108.1
  • CAS Registry: 4430-97-1
  • KEGG: C00822
  • LipidMAPS:
  • BioCYC: DOPAQUINONE
3-hydroxy-3-(3-hydroxyphenyl)propanoic acid-O-sulphate

Formula: C9H10O7S
Exact Mass: 262.0147
Source ID: CNP0084779.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Phosphocreatine

Formula: C4H10N3O5P
Exact Mass: 211.0358
Source ID: CNP0262318.0
  • CAS Registry: 67-07-2
  • KEGG: C02305
  • LipidMAPS:
  • BioCYC: CREATINE-P
L-Xylulose

Formula: C5H10O5
Exact Mass: 150.0528
Source ID: CNP0266174.2
  • CAS Registry: 527-50-4
  • KEGG: C00312
  • LipidMAPS:
  • BioCYC: L-XYLULOSE
4-Nitrophenyl phosphate

Formula: C6H6NO6P
Exact Mass: 218.9933
Source ID: CNP0593593.0
  • CAS Registry: 330-13-2
  • KEGG: C03360
  • LipidMAPS:
  • BioCYC: CPD-194
Gentisuric acid

Formula: C9H9NO5
Exact Mass: 211.0481
Source ID: CNP0377945.0
  • CAS Registry: 25351-24-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
S-Succinyldihydrolipoamide

Formula: C12H21NO4S2
Exact Mass: 307.0912
Source ID: CNP0415697.0
  • CAS Registry:
  • KEGG: C01169
  • LipidMAPS:
  • BioCYC:
4-Hydroxy-5-(3'-hydroxyphenyl)-valeric acid-3'-O-sulphate

Formula: C11H14O7S
Exact Mass: 290.046
Source ID: CNP0202984.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Hydroxy-5-(4'-hydroxyphenyl)-valeric acid-4'-O-sulphate

Formula: C11H14O7S
Exact Mass: 290.046
Source ID: CNP0084802.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-3'-O-sulphate

Formula: C11H12O8S
Exact Mass: 304.0253
Source ID: CNP0084791.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,3,4-Trihydroxybenzoic acid

Formula: C7H6O5
Exact Mass: 170.0215
Source ID: CNP0165116.0
  • CAS Registry: 610-02-6
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD0-2059
4-hydroxybenzoic acid-4-O-sulphate

Formula: C7H6O6S
Exact Mass: 217.9885
Source ID: CNP0325330.0
  • CAS Registry: 3233-38-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Hydroxy-5-(3',4'-dihydroxyphenyl)-valeric acid-O-methyl-O-glucuronide

Formula: C18H26O12
Exact Mass: 434.1424
Source ID: CNP0084798.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Hydroxy-5-(3',5'-dihydroxyphenyl)-valeric acid-O-methyl-O-glucuronide

Formula: C18H26O12
Exact Mass: 434.1424
Source ID: CNP0193979.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-phenylbutanic acid-O-sulphate

Formula: C10H12O5S
Exact Mass: 244.0405
Source ID: CNP0130814.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Hydroxy-5-(phenyl)-valeric acid-O-sulphate

Formula: C11H14O6S
Exact Mass: 274.0511
Source ID: CNP0084788.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-(Hydroxyphenyl)-gamma-valerolactone-O-sulphate

Formula: C11H12O6S
Exact Mass: 272.0355
Source ID: CNP0084758.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-hydroxybenzoic acid-3-O-sulphate

Formula: C7H6O6S
Exact Mass: 217.9885
Source ID: CNP0304471.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Benzeneacetamide-4-O-sulphate

Formula: C8H9NO5S
Exact Mass: 231.0201
Source ID: CNP0160160.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Dihydronaringenin-O-sulphate

Formula: C15H14O8S
Exact Mass: 354.0409
Source ID: CNP0084759.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-(4'-Hydroxyphenyl)-gamma-valerolactone-4'-O-glucuronide

Formula: C20H28O6
Exact Mass: 364.1886
Source ID: CNP0084761.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Monooctyl phthalate

Formula: C16H22O4
Exact Mass: 278.1518
Source ID: CNP0081929.0
  • CAS Registry: 5393-19-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
11-Oxo-androsterone glucuronide

Formula: C25H36O9
Exact Mass: 480.2359
Source ID: CNP0186402.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMST05010032
  • BioCYC: Beta-D-Glucuronides
Mono-(2-ethyl-5-oxohexyl) phthalate

Formula: C16H20O5
Exact Mass: 292.1311
Source ID: CNP0081923.0
  • CAS Registry: 40321-98-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
trans-trans-Muconic acid

Formula: C6H6O4
Exact Mass: 142.0266
Source ID: CNP0248591.0
  • CAS Registry: 3588-17-8
  • KEGG: C03647
  • LipidMAPS: LMFA01170124
  • BioCYC:
4-Hexen-3-one

Formula: C6H10O
Exact Mass: 98.0732
Source ID: CNP0127812.0
  • CAS Registry: 50396-87-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Mercapto-2-propanone

Formula: C3H6OS
Exact Mass: 90.0139
Source ID: CNP0514893.0
  • CAS Registry: 24653-75-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
DG(18:1(11Z)/18:1(11Z)/0:0)

Formula: C39H72O5
Exact Mass: 620.5379
Source ID: CNP0207970.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-(1-Methylethyl)-1-cyclohexene-4-carboxaldehyde

Formula: C10H16O
Exact Mass: 152.1201
Source ID: CNP0091102.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,2,4-Trimethyl-1,3-pentadienol diisobutyrate

Formula: C16H30O4
Exact Mass: 286.2144
Source ID: CNP0084096.0
  • CAS Registry: 6846-50-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Hydroxy-N-formylkynurenine

Formula: C11H12N2O5
Exact Mass: 252.0746
Source ID: CNP0082982.0
  • CAS Registry:
  • KEGG: C05648
  • LipidMAPS:
  • BioCYC:
5-Hydroxykynurenine

Formula: C10H12N2O4
Exact Mass: 224.0797
Source ID: CNP0082980.0
  • CAS Registry: 720-00-3
  • KEGG: C05651
  • LipidMAPS:
  • BioCYC:
4-iminobutane-1,2,3-triol

Formula: C4H9NO3
Exact Mass: 119.0582
Source ID: CNP0082119.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
10-Nitrolinoleic acid

Formula: C18H31NO4
Exact Mass: 325.2253
Source ID: CNP0481166.0
  • CAS Registry: 774603-04-2
  • KEGG: C13800
  • LipidMAPS: LMFA01120001
  • BioCYC:
2-ethylacetoacetic acid

Formula: C6H10O3
Exact Mass: 130.063
Source ID: CNP0082085.0
  • CAS Registry: 4433-85-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol

Formula: C10H15N3O2
Exact Mass: 209.1164
Source ID: CNP0084995.0
  • CAS Registry: 76014-81-8
  • KEGG: C19574
  • LipidMAPS:
  • BioCYC: CPD-21235
5-iminohexane-1,2,3,4,6-pentol

Formula: C6H13NO5
Exact Mass: 179.0794
Source ID: CNP0082088.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-isothiocyanatoethyl phosphate

Formula: C3H6NO4PS
Exact Mass: 182.9755
Source ID: CNP0082092.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-methylcyclopent-1-en-1-ol

Formula: C6H10O
Exact Mass: 98.0732
Source ID: CNP0082123.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-iminohexane-2,3,4,5-tetrol

Formula: C6H13NO4
Exact Mass: 163.0845
Source ID: CNP0091788.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,2-Ethenediol

Formula: C2H4O2
Exact Mass: 60.0211
Source ID: CNP0508859.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-sec-butyl-1,3-dioxolane

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0407840.0
  • CAS Registry: 14447-25-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C11H16O2
Exact Mass: 180.115
Source ID: CNP0082080.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-(4-bromo-6,6,6-trichloro-2-methyl-2-hexanyl)-1,3-dioxolane

Formula: C10H16BrCl3O2
Exact Mass: 351.9399
Source ID: CNP0082090.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C15H26O
Exact Mass: 222.1984
Source ID: CNP0082084.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C11H18O2
Exact Mass: 182.1307
Source ID: CNP0082081.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-methylundec-10-enal

Formula: C12H22O
Exact Mass: 182.1671
Source ID: CNP0082078.0
  • CAS Registry: 95531-03-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-ethyl-3-ketopentanoic acid

Formula: C7H12O3
Exact Mass: 144.0786
Source ID: CNP0333433.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Triclosan sulfate

Formula: C12H7Cl3O5S
Exact Mass: 367.908
Source ID: CNP0084418.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-(3',4'-dihydroxyphenyl)-gamma-valerolactone-3'-O-glucuronide

Formula: C18H22O10
Exact Mass: 398.1213
Source ID: CNP0084432.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Hydroxytetradecanedioic acid

Formula: C14H26O5
Exact Mass: 274.178
Source ID: CNP0240170.0
  • CAS Registry: 73179-89-2
  • KEGG:
  • LipidMAPS: LMFA01170094
  • BioCYC:
PC(20:4(8Z,11Z,14Z,17Z)/P-18:1(9Z))

Formula: C46H82NO7P
Exact Mass: 791.5829
Source ID: CNP0586818.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
Indole-3-carboxilic acid-O-sulphate

Formula: C9H7NO5S
Exact Mass: 241.0045
Source ID: CNP0157750.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Hydroxymethoxyphenylcarboxylic acid-O-sulphate

Formula: C8H10O7S
Exact Mass: 250.0147
Source ID: CNP0084218.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(18:1(9Z)/P-18:1(11Z))

Formula: C44H84NO7P
Exact Mass: 769.5985
Source ID: CNP0541987.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
cis-4-Octenedioic acid

Formula: C8H12O4
Exact Mass: 172.0736
Source ID: CNP0261310.0
  • CAS Registry: 38561-68-1
  • KEGG:
  • LipidMAPS: LMFA01170078
  • BioCYC:
PC(18:1(9Z)/P-18:1(9Z))

Formula: C44H84NO7P
Exact Mass: 769.5985
Source ID: CNP0573162.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
N-acetyl-S-(N-allylthiocarbamoyl)-L-cysteine

Formula: C9H14N2O3S2
Exact Mass: 262.0446
Source ID: CNP0387232.0
  • CAS Registry: 87321-45-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(14:0/P-18:1(9Z))

Formula: C40H78NO7P
Exact Mass: 715.5516
Source ID: CNP0528942.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
Pyrogallol-1-O-sulphate

Formula: C6H6O6S
Exact Mass: 205.9885
Source ID: CNP0123261.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(16:1(9Z)/P-18:0)

Formula: C42H82NO7P
Exact Mass: 743.5829
Source ID: CNP0483538.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-O-methyl-O-sulphate

Formula: C12H14O9S
Exact Mass: 334.0359
Source ID: CNP0084259.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methoxy-4-Hydroxyphenylglycol sulfate

Formula: C9H12O7S
Exact Mass: 264.0304
Source ID: CNP0292318.0
  • CAS Registry: 71324-20-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Hydroxy-benzenepropanedioate

Formula: C9H8O5
Exact Mass: 196.0372
Source ID: CNP0084206.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(18:2(9Z,12Z)/P-16:0)

Formula: C42H80NO7P
Exact Mass: 741.5672
Source ID: CNP0496123.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
Cervonoyl ethanolamide

Formula: C24H36O3
Exact Mass: 372.2664
Source ID: CNP0388411.0
  • CAS Registry:
  • KEGG: C13828
  • LipidMAPS:
  • BioCYC:
Dopamine 4-O-sulfate

Formula: C8H11NO5S
Exact Mass: 233.0358
Source ID: CNP0083956.0
  • CAS Registry: 38339-02-5
  • KEGG: C13691
  • LipidMAPS:
  • BioCYC:
Dopamine 3-O-sulfate

Formula: C8H11NO5S
Exact Mass: 233.0358
Source ID: CNP0083954.0
  • CAS Registry: 51317-41-0
  • KEGG: C13690
  • LipidMAPS:
  • BioCYC: CPD-7649
Pyrogallol-2-O-sulphate

Formula: C6H6O6S
Exact Mass: 205.9885
Source ID: CNP0084223.0
  • CAS Registry: 845253-27-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:1(9Z))

Formula: C46H80NO7P
Exact Mass: 789.5672
Source ID: CNP0478990.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-16:0)

Formula: C44H78NO7P
Exact Mass: 763.5516
Source ID: CNP0566376.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
CE(10:0)

Formula: C37H64O2
Exact Mass: 540.4906
Source ID: CNP0084607.0
  • CAS Registry: 1183-04-6
  • KEGG: C02530
  • LipidMAPS:
  • BioCYC: Cholesterol-esters
Dihydro-2(3H)-thiophenone

Formula: C4H6OS
Exact Mass: 102.0139
Source ID: CNP0084584.0
  • CAS Registry: 1003-10-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(16:0/P-16:0)

Formula: C40H80NO7P
Exact Mass: 717.5672
Source ID: CNP0537965.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
6-Methylnicotinamide

Formula: C8H10N2O
Exact Mass: 150.0793
Source ID: CNP0233596.0
  • CAS Registry: 6960-22-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methylglutaconic acid

Formula: C6H8O4
Exact Mass: 144.0423
Source ID: CNP0273372.0
  • CAS Registry: 5746-90-7
  • KEGG:
  • LipidMAPS: LMFA01170068
  • BioCYC:
PC(20:4(8Z,11Z,14Z,17Z)/P-18:1(11Z))

Formula: C46H82NO7P
Exact Mass: 791.5829
Source ID: CNP0566402.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE


Formula: C57H106O6
Exact Mass: 886.7989
Source ID: CNP0347639.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Penten-3-one, 1-(2,6,6-trimethyl-1-cyclohexen-1-YL)-

Formula: C14H22O
Exact Mass: 206.1671
Source ID: CNP0327008.0
  • CAS Registry: 127-43-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(20:4(8Z,11Z,14Z,17Z)/P-18:0)

Formula: C46H84NO7P
Exact Mass: 793.5985
Source ID: CNP0600572.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE


Formula: C55H102O6
Exact Mass: 858.7676
Source ID: CNP0278727.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(14:1(9Z)/P-18:0)

Formula: C40H78NO7P
Exact Mass: 715.5516
Source ID: CNP0569845.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
2-Aminomuconate semialdehyde

Formula: C6H7NO3
Exact Mass: 141.0426
Source ID: CNP0152302.0
  • CAS Registry: 245128-91-0
  • KEGG: C03824
  • LipidMAPS: LMFA01060191
  • BioCYC: 2-AMINOMUCONATE_SEMIALDEHYDE
Uroporphyrinogen III

Formula: C40H44N4O16
Exact Mass: 836.2752
Source ID: CNP0193461.0
  • CAS Registry: 1976-85-8
  • KEGG: C01051
  • LipidMAPS:
  • BioCYC:


Formula: C55H100O6
Exact Mass: 856.752
Source ID: CNP0084639.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Prostaglandin H3

Formula: C20H30O5
Exact Mass: 350.2093
Source ID: CNP0152466.1
  • CAS Registry: 60114-66-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
10-HETE

Formula: C20H32O3
Exact Mass: 320.2351
Source ID: CNP0102272.0
  • CAS Registry: 167697-52-1
  • KEGG:
  • LipidMAPS: LMFA03060103
  • BioCYC:
3-Furoic acid

Formula: C5H4O3
Exact Mass: 112.016
Source ID: CNP0199311.0
  • CAS Registry: 488-93-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Ureidoisobutyrate

Formula: C5H10N2O3
Exact Mass: 146.0691
Source ID: CNP0374758.0
  • CAS Registry: 19140-82-0
  • KEGG: C05100
  • LipidMAPS:
  • BioCYC: 3-UREIDO-ISOBUTYRATE
Glycodeoxycholate

Formula: C26H43NO5
Exact Mass: 449.3141
Source ID: CNP0172114.4
  • CAS Registry: 360-65-6
  • KEGG: C05464
  • LipidMAPS: LMST05030006
  • BioCYC: GLYCODEOXYCHOLIC_ACID
octadeca-9,12-dienamide

Formula: C18H33NO
Exact Mass: 279.2562
Source ID: CNP0161573.0
  • CAS Registry: 3072-13-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
O-(2-tetradecenoyl)carnitine

Formula: C21H39NO4
Exact Mass: 369.2879
Source ID: CNP0082505.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Methylcitrate

Formula: C7H10O7
Exact Mass: 206.0427
Source ID: CNP0073003.0
  • CAS Registry: 64815-79-8
  • KEGG: C02225
  • LipidMAPS: LMFA01050442
  • BioCYC:
20-OH-Leukotriene B4

Formula: C20H32O5
Exact Mass: 352.225
Source ID: CNP0350117.1
  • CAS Registry: 79516-82-8
  • KEGG: C04853
  • LipidMAPS: LMFA03020018
  • BioCYC:
(R)-2-Ethylmalate

Formula: C6H10O5
Exact Mass: 162.0528
Source ID: CNP0084088.0
  • CAS Registry:
  • KEGG: C02488
  • LipidMAPS: LMFA01050454
  • BioCYC:
2-(2-Phenylacetoxy)propionylglycine

Formula: C13H15NO5
Exact Mass: 265.095
Source ID: CNP0300950.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-Acetylaminooctanoic acid

Formula: C10H19NO3
Exact Mass: 201.1365
Source ID: CNP0511454.0
  • CAS Registry: 5440-37-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4-Dimethylpimelic acid

Formula: C9H16O4
Exact Mass: 188.1049
Source ID: CNP0229169.0
  • CAS Registry: 5325-75-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
xanthurenic acid 8-O-sulfate

Formula: C10H7NO7S
Exact Mass: 284.9943
Source ID: CNP0084087.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Indolehydracrylic acid

Formula: C11H11NO3
Exact Mass: 205.0739
Source ID: CNP0084095.0
  • CAS Registry: 126489-20-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(P-18:1(11Z)/22:2(13Z,16Z))

Formula: C48H90NO7P
Exact Mass: 823.6455
Source ID: CNP0566280.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMGP01030140
  • BioCYC:
PC(P-18:1(11Z)/18:3(6Z,9Z,12Z))

Formula: C44H80NO7P
Exact Mass: 765.5672
Source ID: CNP0491036.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(P-16:0/20:3(5Z,8Z,11Z))

Formula: C44H82NO7P
Exact Mass: 767.5829
Source ID: CNP0511662.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMGP01030129
  • BioCYC:
1-Methyladenosine

Formula: C11H15N5O4
Exact Mass: 281.1124
Source ID: CNP0348508.1
  • CAS Registry: 15763-06-1
  • KEGG: C02494
  • LipidMAPS:
  • BioCYC: 1-METHYLADENOSINE
[(2~{R})-2-hydroxy-3-[hydroxy-[(2~{R},3~{R},5~{S},6~{R})-2,3,4,5,6-pentahydroxycyclohexoxy]phosphoryl]oxy-propyl] octadecanoate

Formula: C27H53O12P
Exact Mass: 600.3274
Source ID: CNP0082504.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[(2~{R})-2-hydroxy-3-[hydroxy-[(2~{R},3~{R},5~{S},6~{R})-2,3,4,5,6-pentahydroxycyclohexoxy]phosphoryl]oxy-propyl] (5~{Z},8~{Z},11~{Z},14~{Z})-icosa-5,8,11,14-tetraenoate

Formula: C29H49O12P
Exact Mass: 620.2961
Source ID: CNP0368579.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
alpha-D-Ribose 1-phosphate

Formula: C5H11O8P
Exact Mass: 230.0192
Source ID: CNP0082936.1
  • CAS Registry: 14075-00-4
  • KEGG: C00620
  • LipidMAPS:
  • BioCYC: RIBOSE-1P
P1,P4-Bis(5'-adenosyl)tetraphosphate

Formula: C20H28N10O19P4
Exact Mass: 836.0483
Source ID: CNP0083600.1
  • CAS Registry: 5542-28-9
  • KEGG: C01260
  • LipidMAPS:
  • BioCYC:
NADH

Formula: C21H29N7O14P2
Exact Mass: 665.1248
Source ID: CNP0222405.1
  • CAS Registry: 58-68-4
  • KEGG: C00004
  • LipidMAPS:
  • BioCYC:
Hydroxymethylbilane

Formula: C40H46N4O17
Exact Mass: 854.2858
Source ID: CNP0212522.0
  • CAS Registry: 71861-60-4
  • KEGG: C01024
  • LipidMAPS:
  • BioCYC:
4-Aminobutyraldehyde

Formula: C4H9NO
Exact Mass: 87.0684
Source ID: CNP0359033.0
  • CAS Registry: 4390-05-0
  • KEGG: C00555
  • LipidMAPS:
  • BioCYC:
Phenylglyoxal

Formula: C8H6O2
Exact Mass: 134.0368
Source ID: CNP0256547.0
  • CAS Registry: 1074-12-0
  • KEGG:
  • LipidMAPS:
  • BioCYC: PHENYLGLYOXAL
Trihydroxybutane

Formula: C4H10O3
Exact Mass: 106.063
Source ID: CNP0084720.0
  • CAS Registry: 164171-32-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4-Dimethyl-3-pentanone

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0084721.0
  • CAS Registry: 565-80-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
CE(14:0)

Formula: C41H72O2
Exact Mass: 596.5532
Source ID: CNP0138027.1
  • CAS Registry: 1989-52-2
  • KEGG:
  • LipidMAPS: LMST01020004
  • BioCYC:
N-butylformamide

Formula: C5H11NO
Exact Mass: 101.0841
Source ID: CNP0082472.0
  • CAS Registry: 871-71-6
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-12598
TG 18:1(9Z)/18:2(9Z,12Z)/18:2(9Z,12Z)

Formula: C57H100O6
Exact Mass: 880.752
Source ID: CNP0191926.1
  • CAS Registry: 64550-35-2
  • KEGG:
  • LipidMAPS: LMGL03010327
  • BioCYC:
CO2

Formula: CO2
Exact Mass: 43.9898
Source ID: CNP0566212.0
  • CAS Registry: 124-38-9
  • KEGG: C00011
  • LipidMAPS:
  • BioCYC: CARBON-DIOXIDE
2-((2-Chloroethyl)ethylamino)ethanol

Formula: C6H14ClNO
Exact Mass: 151.0764
Source ID: CNP0082053.0
  • CAS Registry: 4669-20-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Ninhydrin

Formula: C9H6O4
Exact Mass: 178.0266
Source ID: CNP0082308.0
  • CAS Registry: 485-47-2
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-9188
17-phenyl-18,19,20-trinor-prostaglandin E2

Formula: C23H30O5
Exact Mass: 386.2093
Source ID: CNP0350156.1
  • CAS Registry: 38315-43-4
  • KEGG:
  • LipidMAPS: LMFA03010067
  • BioCYC:
Hyocholic acid

Formula: C24H40O5
Exact Mass: 408.2876
Source ID: CNP0234996.4
  • CAS Registry: 547-75-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N(1)-isopropyl-2-methylpropan-1,2-diamine

Formula: C7H18N2
Exact Mass: 130.147
Source ID: CNP0083049.0
  • CAS Registry: 5448-29-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
vinyl benzoate

Formula: C9H8O2
Exact Mass: 148.0524
Source ID: CNP0083042.0
  • CAS Registry: 769-78-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
TG(16:0/18:2(9Z,12Z)/18:2(9Z,12Z))[iso3]

Formula: C55H98O6
Exact Mass: 854.7363
Source ID: CNP0273533.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMGL03010141
  • BioCYC: Triacylglycerols
Pregnanediol-3-glucuronide

Formula: C27H44O8
Exact Mass: 496.3036
Source ID: CNP0169211.1
  • CAS Registry: 1852-49-9
  • KEGG:
  • LipidMAPS: LMST05010049
  • BioCYC:
5-Acetylamino-6-amino-3-methyluracil

Formula: C7H10N4O3
Exact Mass: 198.0753
Source ID: CNP0363116.0
  • CAS Registry: 19893-78-8
  • KEGG: C16366
  • LipidMAPS:
  • BioCYC:
Cholesteryl palmitate

Formula: C43H76O2
Exact Mass: 624.5845
Source ID: CNP0154168.1
  • CAS Registry: 601-34-3
  • KEGG: C11251
  • LipidMAPS: LMST01020005
  • BioCYC: CPD-21814
Propyl 2-methylpropanoate

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0084342.0
  • CAS Registry: 644-49-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
TG 50:0

Formula: C53H102O6
Exact Mass: 834.7676
Source ID: CNP0084614.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Itaconate

Formula: C5H6O4
Exact Mass: 130.0266
Source ID: CNP0269442.0
  • CAS Registry: 97-65-4
  • KEGG: C00490
  • LipidMAPS: LMFA01170063
  • BioCYC: ITACONATE
Nicotinamide N-oxide

Formula: C6H6N2O2
Exact Mass: 138.0429
Source ID: CNP0508767.0
  • CAS Registry: 1986-81-8
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD0-2083
N4-Acetylaminobutanal

Formula: C6H11NO2
Exact Mass: 129.079
Source ID: CNP0083670.0
  • CAS Registry: 24431-54-7
  • KEGG: C05936
  • LipidMAPS:
  • BioCYC: CPD-30
Coproporphyrinogen III

Formula: C36H44N4O8
Exact Mass: 660.3159
Source ID: CNP0085566.0
  • CAS Registry: 2624-63-7
  • KEGG: C03263
  • LipidMAPS:
  • BioCYC:
Dephospho-CoA

Formula: C21H35N7O13P2S
Exact Mass: 687.1489
Source ID: CNP0235817.1
  • CAS Registry: 3633-59-8
  • KEGG: C00882
  • LipidMAPS: LMFA07050315
  • BioCYC:
Glyoxylate

Formula: C2H2O3
Exact Mass: 74.0004
Source ID: CNP0571230.0
  • CAS Registry: 298-12-4
  • KEGG: C00048
  • LipidMAPS:
  • BioCYC: GLYOX
4-Hydroxyphenylacetaldehyde

Formula: C8H8O2
Exact Mass: 136.0524
Source ID: CNP0103441.0
  • CAS Registry: 7339-87-9
  • KEGG: C03765
  • LipidMAPS:
  • BioCYC: HYDRPHENYLAC-CPD
Leukotriene B4

Formula: C20H32O4
Exact Mass: 336.23
Source ID: CNP0227899.1
  • CAS Registry: 71160-24-2
  • KEGG: C02165
  • LipidMAPS: LMFA03020001
  • BioCYC:
3,4-Methyleneadipic acid

Formula: C8H10O4
Exact Mass: 170.0579
Source ID: CNP0116390.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Leukotriene C4

Formula: C30H47N3O9S
Exact Mass: 625.3033
Source ID: CNP0381907.1
  • CAS Registry: 72025-60-6
  • KEGG: C02166
  • LipidMAPS: LMFA03020003
  • BioCYC: LEUKOTRIENE-C4
methyl cyclopropanecarboxylate

Formula: C5H8O2
Exact Mass: 100.0524
Source ID: CNP0386382.0
  • CAS Registry: 2868-37-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-(3-acetamidopropyl)pyrrolidin-2-one

Formula: C9H16N2O2
Exact Mass: 184.1212
Source ID: CNP0205490.0
  • CAS Registry: 106692-36-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cysteamine

Formula: C2H7NS
Exact Mass: 77.0299
Source ID: CNP0490978.0
  • CAS Registry: 60-23-1
  • KEGG: C01678
  • LipidMAPS:
  • BioCYC: CPD-239
Monoisopropyl phthalate

Formula: C11H12O4
Exact Mass: 208.0736
Source ID: CNP0081928.0
  • CAS Registry: 35118-50-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Taurodeoxycholate

Formula: C26H45NO6S
Exact Mass: 499.2967
Source ID: CNP0198517.2
  • CAS Registry: 516-50-7
  • KEGG: C05463
  • LipidMAPS: LMST05040013
  • BioCYC:
LPC 22:6

Formula: C30H50NO7P
Exact Mass: 567.3325
Source ID: CNP0573894.1
  • CAS Registry: 162440-05-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Glycylvaline

Formula: C7H14N2O3
Exact Mass: 174.1004
Source ID: CNP0381435.1
  • CAS Registry: 1963-21-9
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-20341
(R)-5-Diphosphomevalonate

Formula: C6H14O10P2
Exact Mass: 308.0062
Source ID: CNP0085584.1
  • CAS Registry: 103025-21-4
  • KEGG: C01143
  • LipidMAPS: LMFA01050416
  • BioCYC:


Formula: C6H10O5
Exact Mass: 162.0528
Source ID: CNP0224084.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Phospho-D-glycerate

Formula: C3H7O7P
Exact Mass: 185.9929
Source ID: CNP0302270.1
  • CAS Registry: 3443-58-1
  • KEGG: C00197
  • LipidMAPS:
  • BioCYC: G3P
Sphinganine 1-phosphate

Formula: C18H40NO5P
Exact Mass: 381.2644
Source ID: CNP0347052.1
  • CAS Registry: 19794-97-9
  • KEGG: C01120
  • LipidMAPS: LMSP01050002
  • BioCYC:
Prop-2-enylcyclohexane

Formula: C9H16
Exact Mass: 124.1252
Source ID: CNP0156672.0
  • CAS Registry: 2114-42-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Butyl pentanoate

Formula: C9H18O2
Exact Mass: 158.1307
Source ID: CNP0085853.0
  • CAS Registry: 591-68-4
  • KEGG:
  • LipidMAPS: LMFA07010796
  • BioCYC:
Androsterone

Formula: C19H30O2
Exact Mass: 290.2246
Source ID: CNP0199434.2
  • CAS Registry: 53-41-8
  • KEGG: C00523
  • LipidMAPS: LMST02020001
  • BioCYC: ANDROSTERONE
5alpha-Androstane-3,17-dione

Formula: C19H28O2
Exact Mass: 288.2089
Source ID: CNP0260421.1
  • CAS Registry: 846-46-8
  • KEGG: C00674
  • LipidMAPS: LMST02020085
  • BioCYC: CPD-342
5alpha-Cholest-8-en-3beta-ol

Formula: C27H46O
Exact Mass: 386.3548
Source ID: CNP0132603.1
  • CAS Registry: 566-97-2
  • KEGG: C03845
  • LipidMAPS: LMST01010096
  • BioCYC: CPD-8621
2-Methylerythritol

Formula: C5H12O4
Exact Mass: 136.0736
Source ID: CNP0176272.3
  • CAS Registry: 93921-83-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
11-trans-Leukotriene C4

Formula: C30H47N3O9S
Exact Mass: 625.3033
Source ID: CNP0381907.2
  • CAS Registry: 74841-69-3
  • KEGG:
  • LipidMAPS: LMFA03020020
  • BioCYC:
1-(1-Methylethenyl)-4-(1-methylethyl)benzene

Formula: C12H16
Exact Mass: 160.1252
Source ID: CNP0084857.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-(3-Methylbutyl)-cyclopentene

Formula: C10H18
Exact Mass: 138.1408
Source ID: CNP0084867.0
  • CAS Registry: 37689-15-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3,3,5,6-Tetramethyl-1-indanone

Formula: C13H16O
Exact Mass: 188.1201
Source ID: CNP0084313.0
  • CAS Registry: 54789-22-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Phenylalanylphenylalanine

Formula: C18H20N2O3
Exact Mass: 312.1474
Source ID: CNP0348037.1
  • CAS Registry: 2577-40-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4-Dimethylfuran

Formula: C6H8O
Exact Mass: 96.0575
Source ID: CNP0386095.0
  • CAS Registry: 3710-43-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
gamma-Glutamylleucine

Formula: C11H20N2O5
Exact Mass: 260.1372
Source ID: CNP0259843.1
  • CAS Registry: 2566-39-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
7alpha-hydroxyestradiol

Formula: C18H24O3
Exact Mass: 288.1725
Source ID: CNP0199044.1
  • CAS Registry: 3398-11-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
allyl octadecyl oxalate

Formula: C23H42O4
Exact Mass: 382.3083
Source ID: CNP0083047.0
  • CAS Registry: 959312-47-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(R)-Lactaldehyde

Formula: C3H6O2
Exact Mass: 74.0368
Source ID: CNP0482941.1
  • CAS Registry: 3946-09-6
  • KEGG: C00937
  • LipidMAPS:
  • BioCYC: CPD-358
Cortisone

Formula: C21H28O5
Exact Mass: 360.1937
Source ID: CNP0233309.2
  • CAS Registry: 53-06-5
  • KEGG: C00762
  • LipidMAPS: LMST02030090
  • BioCYC: CORTISONE
Glycerophosphocholine

Formula: C8H20NO6P
Exact Mass: 257.1028
Source ID: CNP0541968.1
  • CAS Registry: 28319-77-9
  • KEGG: C00670
  • LipidMAPS:
  • BioCYC: L-1-GLYCERO-PHOSPHORYLCHOLINE
3-Methoxyphenylacetic acid

Formula: C9H10O3
Exact Mass: 166.063
Source ID: CNP0272560.0
  • CAS Registry: 1798-09-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,3-Methylene suberic acid

Formula: C10H14O4
Exact Mass: 198.0892
Source ID: CNP0318682.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
HpODE

Formula: C18H32O4
Exact Mass: 312.23
Source ID: CNP0367878.1
  • CAS Registry: 33964-75-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Methoxysalicylic acid

Formula: C8H8O4
Exact Mass: 168.0423
Source ID: CNP0195415.0
  • CAS Registry: 2612-02-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Hydroxypyrene

Formula: C16H10O
Exact Mass: 218.0732
Source ID: CNP0327812.0
  • CAS Registry: 5315-79-7
  • KEGG: C14519
  • LipidMAPS:
  • BioCYC:
Lipoxin A4

Formula: C20H32O5
Exact Mass: 352.225
Source ID: CNP0141285.1
  • CAS Registry: 89663-86-5
  • KEGG: C06314
  • LipidMAPS: LMFA03040010
  • BioCYC:
Cortol

Formula: C21H36O5
Exact Mass: 368.2563
Source ID: CNP0380282.1
  • CAS Registry: 516-38-1
  • KEGG: C05482
  • LipidMAPS: LMST02030228
  • BioCYC: CORTOL
5a-Tetrahydrocorticosterone

Formula: C21H34O4
Exact Mass: 350.2457
Source ID: CNP0228137.1
  • CAS Registry: 600-63-5
  • KEGG:
  • LipidMAPS: LMST02030142
  • BioCYC:
Cyclohexylamine

Formula: C6H13N
Exact Mass: 99.1048
Source ID: CNP0149842.0
  • CAS Registry: 108-91-8
  • KEGG: C00571
  • LipidMAPS:
  • BioCYC: CPD-303
3-Oxoglutaric acid

Formula: C5H6O5
Exact Mass: 146.0215
Source ID: CNP0280291.0
  • CAS Registry: 542-05-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methylthiophene

Formula: C5H6S
Exact Mass: 98.019
Source ID: CNP0153726.0
  • CAS Registry: 616-44-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
beta-Nicotinamide mononucleotide

Formula: C11H15N2O8P
Exact Mass: 334.0566
Source ID: CNP0492107.1
  • CAS Registry: 1094-61-7
  • KEGG: C00455
  • LipidMAPS:
  • BioCYC:
4-Trimethylammoniobutanoate

Formula: C7H16NO2
Exact Mass: 146.1181
Source ID: CNP0083679.0
  • CAS Registry: 10329-41-6
  • KEGG: C01181
  • LipidMAPS:
  • BioCYC:
N-Acetoxy-IQ

Formula: C13H12N4O2
Exact Mass: 256.096
Source ID: CNP0256545.0
  • CAS Registry: 115722-78-6
  • KEGG: C20290
  • LipidMAPS:
  • BioCYC:
2-Methoxyestrone

Formula: C19H24O3
Exact Mass: 300.1725
Source ID: CNP0402404.1
  • CAS Registry: 362-08-3
  • KEGG: C05299
  • LipidMAPS: LMST02010033
  • BioCYC:
8-Hydroxyadenine

Formula: C5H5N5O
Exact Mass: 151.0494
Source ID: CNP0500901.0
  • CAS Registry: 21149-26-8
  • KEGG: C22499
  • LipidMAPS:
  • BioCYC:
(15S)-15-Hydroxy-5,8,11-cis-13-trans-eicosatetraenoate

Formula: C20H32O3
Exact Mass: 320.2351
Source ID: CNP0182179.1
  • CAS Registry: 54845-95-3
  • KEGG: C04742
  • LipidMAPS: LMFA03060087
  • BioCYC:
6-Methoxy-pyridine-3-carboxylic acid

Formula: C7H7NO3
Exact Mass: 153.0426
Source ID: CNP0193366.0
  • CAS Registry: 66572-55-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3,4-Methylenepimelic acid

Formula: C9H12O4
Exact Mass: 184.0736
Source ID: CNP0084075.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,3-Methylenesuccinic acid

Formula: C6H6O4
Exact Mass: 142.0266
Source ID: CNP0156637.0
  • CAS Registry: 488-20-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,3-Methyleneglutaric acid

Formula: C7H8O4
Exact Mass: 156.0423
Source ID: CNP0084078.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(R)-2,3-Dihydroxy-3-methylbutanoate

Formula: C5H10O4
Exact Mass: 134.0579
Source ID: CNP0224141.1
  • CAS Registry: 19451-56-0
  • KEGG: C04272
  • LipidMAPS: LMFA01050453
  • BioCYC:
TG(18:0/18:2(9Z,12Z)/18:2(9Z,12Z))[iso3]

Formula: C57H102O6
Exact Mass: 882.7676
Source ID: CNP0123669.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMGL03010287
  • BioCYC: Triacylglycerols
1,4,5-Trimethyl-naphtalene

Formula: C13H14
Exact Mass: 170.1095
Source ID: CNP0084069.0
  • CAS Registry: 2131-41-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Lacto-N-fucopentaose-2

Formula: C32H55NO25
Exact Mass: 853.3063
Source ID: CNP0315593.1
  • CAS Registry: 21973-23-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
SM(d18:1/18:0)

Formula: C41H83N2O6P
Exact Mass: 730.5988
Source ID: CNP0526127.1
  • CAS Registry: 58909-84-5
  • KEGG: C00550
  • LipidMAPS: LMSP03010001
  • BioCYC:
3beta-Hydroxy-5beta-pregnane-20-one

Formula: C21H34O2
Exact Mass: 318.2559
Source ID: CNP0198649.3
  • CAS Registry: 128-21-2
  • KEGG: C11825
  • LipidMAPS: LMST02030185
  • BioCYC: CPD-5961
4-Methylthio-2-oxobutanoic acid

Formula: C5H8O3S
Exact Mass: 148.0194
Source ID: CNP0135111.0
  • CAS Registry: 583-92-6
  • KEGG: C01180
  • LipidMAPS: LMFA01060170
  • BioCYC:
Monoisodecyl phthalate

Formula: C18H26O4
Exact Mass: 306.1831
Source ID: CNP0081924.0
  • CAS Registry: 31047-64-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Dimethylmalonic acid

Formula: C5H8O4
Exact Mass: 132.0423
Source ID: CNP0082122.0
  • CAS Registry: 595-46-0
  • KEGG:
  • LipidMAPS: LMFA01170103
  • BioCYC:
2-Oxohexanoic acid

Formula: C6H10O3
Exact Mass: 130.063
Source ID: CNP0301313.0
  • CAS Registry: 2492-75-3
  • KEGG: C00902
  • LipidMAPS: LMFA01060007
  • BioCYC:
2,5-Furandicarboxylate

Formula: C6H4O5
Exact Mass: 156.0059
Source ID: CNP0212337.0
  • CAS Registry: 3238-40-2
  • KEGG: C20450
  • LipidMAPS:
  • BioCYC: CPD-14105
5-Acetylamino-6-formylamino-3-methyluracil

Formula: C8H10N4O4
Exact Mass: 226.0702
Source ID: CNP0083480.0
  • CAS Registry: 85438-96-6
  • KEGG: C16365
  • LipidMAPS:
  • BioCYC:
Carbonic acid

Formula: H2CO3
Exact Mass: 62.0004
Source ID: CNP0491655.0
  • CAS Registry: 463-79-6
  • KEGG: C01353
  • LipidMAPS:
  • BioCYC: H2CO3
3,4-Methylenesebacic acid

Formula: C12H18O4
Exact Mass: 226.1205
Source ID: CNP0084062.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Hypothiocyanite

Formula: CHNOS
Exact Mass: 74.9779
Source ID: CNP0569271.0
  • CAS Registry: 63296-34-4
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-26678
N,N-dipropylformamide

Formula: C7H15NO
Exact Mass: 129.1154
Source ID: CNP0082253.0
  • CAS Registry: 6282-00-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Dopaxanthin

Formula: C18H18N2O8
Exact Mass: 390.1063
Source ID: CNP0216252.1
  • CAS Registry: 71199-31-0
  • KEGG: C08543
  • LipidMAPS:
  • BioCYC: CPD-8672
4-Bromophenol

Formula: C6H5BrO
Exact Mass: 171.9524
Source ID: CNP0085593.0
  • CAS Registry: 106-41-2
  • KEGG: C14453
  • LipidMAPS:
  • BioCYC: CPD-18749
Enterolactone

Formula: C18H18O4
Exact Mass: 298.1205
Source ID: CNP0106907.2
  • CAS Registry: 78473-71-9
  • KEGG: C18165
  • LipidMAPS:
  • BioCYC: 2-CHLORO-TRANS-DIENELACTONE
(+)-Nornicotine

Formula: C9H12N2
Exact Mass: 148.1
Source ID: CNP0110438.1
  • CAS Registry: 7076-23-5
  • KEGG: C11360
  • LipidMAPS:
  • BioCYC: CPD-2748
1-isopentyl-2,3,4,6-tetramethylbenzene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0397850.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
11-Dehydrocorticosterone

Formula: C21H28O4
Exact Mass: 344.1987
Source ID: CNP0138042.1
  • CAS Registry: 72-23-1
  • KEGG: C05490
  • LipidMAPS: LMST02030192
  • BioCYC: CPD-23991
Heptyl acetate

Formula: C9H18O2
Exact Mass: 158.1307
Source ID: CNP0082049.0
  • CAS Registry: 112-06-1
  • KEGG:
  • LipidMAPS: LMFA07010186
  • BioCYC:
(5-L-Glutamyl)-L-glutamine

Formula: C10H17N3O6
Exact Mass: 275.1117
Source ID: CNP0131898.1
  • CAS Registry: 10148-81-9
  • KEGG: C05283
  • LipidMAPS:
  • BioCYC:
LysoPC(17:0/0:0)

Formula: C25H52NO7P
Exact Mass: 509.3481
Source ID: CNP0499300.1
  • CAS Registry: 50930-23-9
  • KEGG: C04230
  • LipidMAPS: LMGP01050024
  • BioCYC: CPD-20404
(5-L-Glutamyl)-L-glutamate

Formula: C10H16N2O7
Exact Mass: 276.0957
Source ID: CNP0372751.1
  • CAS Registry: 1116-22-9
  • KEGG: C05282
  • LipidMAPS:
  • BioCYC:
Cerebrosterol

Formula: C27H46O2
Exact Mass: 402.3498
Source ID: CNP0243371.1
  • CAS Registry: 474-73-7
  • KEGG: C13550
  • LipidMAPS: LMST01010019
  • BioCYC: CPD-7239
Aflatoxin B1-exo-8,9-epoxide

Formula: C17H12O7
Exact Mass: 328.0583
Source ID: CNP0247911.1
  • CAS Registry: 42583-46-0
  • KEGG: C19586
  • LipidMAPS:
  • BioCYC:
Succinate semialdehyde

Formula: C4H6O3
Exact Mass: 102.0317
Source ID: CNP0318740.0
  • CAS Registry: 692-29-5
  • KEGG: C00232
  • LipidMAPS: LMFA06000118
  • BioCYC:
N-Acetylputrescine

Formula: C6H14N2O
Exact Mass: 130.1106
Source ID: CNP0279373.0
  • CAS Registry: 5699-41-2
  • KEGG: C02714
  • LipidMAPS:
  • BioCYC: CPD-569
3,5-Bis(1,1-dimethylethyl)-4-hydroxy-benzoic acid ethyl ester

Formula: C16H24O3
Exact Mass: 264.1725
Source ID: CNP0084722.0
  • CAS Registry: 2511-22-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,3-Di-tert-butylbenzene

Formula: C14H22
Exact Mass: 190.1721
Source ID: CNP0301826.0
  • CAS Registry: 1014-60-4
  • KEGG: C71072
  • LipidMAPS:
  • BioCYC:
P,P-Dioctyldiphenylamine

Formula: C28H43N
Exact Mass: 393.3395
Source ID: CNP0084700.0
  • CAS Registry: 101-67-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Hexyl dodecanoate

Formula: C18H36O2
Exact Mass: 284.2715
Source ID: CNP0084717.0
  • CAS Registry: 34316-64-8
  • KEGG:
  • LipidMAPS: LMFA07010466
  • BioCYC:
2-Acetyl-4,5-dihydrothiazole

Formula: C5H7NOS
Exact Mass: 129.0248
Source ID: CNP0314026.0
  • CAS Registry: 29926-41-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Methyl dihydrojasmonate

Formula: C13H22O3
Exact Mass: 226.1569
Source ID: CNP0239046.1
  • CAS Registry: 24851-98-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isopropyl butyrate

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0194975.0
  • CAS Registry: 638-11-9
  • KEGG:
  • LipidMAPS: LMFA07010673
  • BioCYC:
3-Iodothyronamine

Formula: C14H14INO2
Exact Mass: 355.0069
Source ID: CNP0084178.0
  • CAS Registry: 712349-95-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3,3-dimethyl-1-cyclohexen-1-ol

Formula: C8H14O
Exact Mass: 126.1045
Source ID: CNP0082060.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2(N)-Methyl-norsalsolinol

Formula: C10H13NO2
Exact Mass: 179.0946
Source ID: CNP0184733.0
  • CAS Registry: 63937-92-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5a-Androst-3-en-17-one

Formula: C19H28O
Exact Mass: 272.214
Source ID: CNP0389993.1
  • CAS Registry: 14935-81-0
  • KEGG:
  • LipidMAPS: LMST02020094
  • BioCYC:
t-butyl hexadecanoate

Formula: C20H40O2
Exact Mass: 312.3028
Source ID: CNP0230085.0
  • CAS Registry: 31158-91-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Succinylacetone

Formula: C7H10O4
Exact Mass: 158.0579
Source ID: CNP0178580.0
  • CAS Registry: 51568-18-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Methoxy-4-propylbenzene

Formula: C10H14O
Exact Mass: 150.1045
Source ID: CNP0255936.0
  • CAS Registry: 104-45-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(19:0/0:0)

Formula: C27H56NO7P
Exact Mass: 537.3794
Source ID: CNP0541826.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMGP01050041
  • BioCYC:
Benzyl isothiocyanate

Formula: C8H7NS
Exact Mass: 149.0299
Source ID: CNP0278893.0
  • CAS Registry: 622-78-6
  • KEGG: C03098
  • LipidMAPS:
  • BioCYC: BENZYL-ISOTHIOCYANATE
1-(1-methylethenyl)-3-(1-methylethyl)-benzene

Formula: C12H16
Exact Mass: 160.1252
Source ID: CNP0084858.0
  • CAS Registry: 1129-29-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2-ethoxyethoxy)acetic acid

Formula: C6H12O4
Exact Mass: 148.0736
Source ID: CNP0083036.0
  • CAS Registry: 7743-94-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Oxo-4,6-choladienoic acid

Formula: C24H34O3
Exact Mass: 370.2508
Source ID: CNP0269157.1
  • CAS Registry: 88179-71-9
  • KEGG:
  • LipidMAPS: LMST04010235
  • BioCYC:
5-Androstenetriol

Formula: C19H30O3
Exact Mass: 306.2195
Source ID: CNP0186121.1
  • CAS Registry: 4150-30-5
  • KEGG:
  • LipidMAPS: LMST02020099
  • BioCYC:
16alpha-Hydroxyestrone

Formula: C18H22O3
Exact Mass: 286.1569
Source ID: CNP0163379.2
  • CAS Registry: 566-76-7
  • KEGG: C05300
  • LipidMAPS: LMST02010041
  • BioCYC:
Resolvin D1

Formula: C22H32O5
Exact Mass: 376.225
Source ID: CNP0083906.1
  • CAS Registry: 872993-05-0
  • KEGG: C18178
  • LipidMAPS: LMFA04030011
  • BioCYC: CPD66-64
Behenoylglycine

Formula: C24H47NO3
Exact Mass: 397.3556
Source ID: CNP0082289.0
  • CAS Registry: 14246-59-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tetracosanoylglycine

Formula: C26H51NO3
Exact Mass: 425.3869
Source ID: CNP0266144.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
~{N}3,~{N}7,~{N}7-trimethylphenothiazin-5-ium-3,7-diamine chloride

Formula: C15H16ClN3S
Exact Mass: 305.0753
Source ID: CNP0487370.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4-dimethylpentan-3-amine

Formula: C7H17N
Exact Mass: 115.1361
Source ID: CNP0083055.0
  • CAS Registry: 4083-57-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isobutyric Acid Anhydride

Formula: C8H14O3
Exact Mass: 158.0943
Source ID: CNP0300991.0
  • CAS Registry: 97-72-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-(4-methoxyphenyl)propan-2-ol

Formula: C10H14O2
Exact Mass: 166.0994
Source ID: CNP0083065.0
  • CAS Registry: 7428-99-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
pentan-3-amine

Formula: C5H13N
Exact Mass: 87.1048
Source ID: CNP0103985.0
  • CAS Registry: 616-24-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-methylbutan-2-amine

Formula: C5H13N
Exact Mass: 87.1048
Source ID: CNP0083061.0
  • CAS Registry: 594-39-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
D-Ribulose

Formula: C5H10O5
Exact Mass: 150.0528
Source ID: CNP0266174.3
  • CAS Registry: 488-84-6
  • KEGG: C00309
  • LipidMAPS:
  • BioCYC: CPD-24939
11-nitro-1-undecene

Formula: C11H21NO2
Exact Mass: 199.1572
Source ID: CNP0523430.0
  • CAS Registry: 40244-98-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
n-Propylbenzamide

Formula: C10H13NO
Exact Mass: 163.0997
Source ID: CNP0268362.0
  • CAS Registry: 10546-70-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Ethyl Phenylglyoxylate

Formula: C10H10O3
Exact Mass: 178.063
Source ID: CNP0318781.0
  • CAS Registry: 1603-79-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,3-Diaminosalicylic acid

Formula: C7H8N2O3
Exact Mass: 168.0535
Source ID: CNP0308763.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-Methylputrescine

Formula: C5H14N2
Exact Mass: 102.1157
Source ID: CNP0157274.0
  • CAS Registry: 14475-60-6
  • KEGG: C02723
  • LipidMAPS:
  • BioCYC:
11-Deoxycorticosterone

Formula: C21H30O3
Exact Mass: 330.2195
Source ID: CNP0239493.1
  • CAS Registry: 64-85-7
  • KEGG: C03205
  • LipidMAPS: LMST02030087
  • BioCYC: 11-DEOXYCORTICOSTERONE
Monoisononyl phthalate

Formula: C17H24O4
Exact Mass: 292.1675
Source ID: CNP0081926.0
  • CAS Registry: 106610-61-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-(2-Aminophenyl)-2,4-dioxobutanoate

Formula: C10H9NO4
Exact Mass: 207.0532
Source ID: CNP0083599.0
  • CAS Registry: 90924-76-8
  • KEGG: C01252
  • LipidMAPS:
  • BioCYC:
Propyl pentanoate

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0084151.0
  • CAS Registry: 141-06-0
  • KEGG:
  • LipidMAPS: LMFA07011005
  • BioCYC:
3-Hydroxy-3-carboxymethyl-adipic acid

Formula: C8H12O7
Exact Mass: 220.0583
Source ID: CNP0084105.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Methoxytryptophol

Formula: C11H13NO2
Exact Mass: 191.0946
Source ID: CNP0209412.0
  • CAS Registry: 712-09-4
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-12021
3alpha,11beta-Dihydroxy-5alpha-androstane-17-one

Formula: C19H30O3
Exact Mass: 306.2195
Source ID: CNP0144130.3
  • CAS Registry: 57-61-4
  • KEGG: C14606
  • LipidMAPS: LMST02020086
  • BioCYC:
Lipoxin B4

Formula: C20H32O5
Exact Mass: 352.225
Source ID: CNP0403724.1
  • CAS Registry: 98049-69-5
  • KEGG: C06315
  • LipidMAPS: LMFA03040002
  • BioCYC:
Tetrahydrodeoxycorticosterone

Formula: C21H34O3
Exact Mass: 334.2508
Source ID: CNP0139196.1
  • CAS Registry: 567-03-3
  • KEGG: C13713
  • LipidMAPS: LMST02030283
  • BioCYC:
11-Ketoetiocholanolone

Formula: C19H28O3
Exact Mass: 304.2038
Source ID: CNP0198775.1
  • CAS Registry: 739-27-5
  • KEGG: C14552
  • LipidMAPS: LMST02020123
  • BioCYC:
Tetrahydrocortisone

Formula: C21H32O5
Exact Mass: 364.225
Source ID: CNP0235987.3
  • CAS Registry: 53-05-4
  • KEGG: C05470
  • LipidMAPS: LMST02030098
  • BioCYC: UROCORTISONE
2,2',4,4'-Tetrabromodiphenyl ether

Formula: C12H6Br4O
Exact Mass: 481.7152
Source ID: CNP0084996.0
  • CAS Registry: 5436-43-1
  • KEGG: C18205
  • LipidMAPS:
  • BioCYC: CPD-20555
undecane-1,11-diol

Formula: C11H24O2
Exact Mass: 188.1776
Source ID: CNP0368503.0
  • CAS Registry: 765-04-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-phenyl-2H-oxadiazol-3-ium-5-thione

Formula: [C8H7N2OS]+
Exact Mass: 179.0279
Source ID: CNP0484887.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Methyl-5-(methylthio)furan

Formula: C6H8OS
Exact Mass: 128.0296
Source ID: CNP0304917.0
  • CAS Registry: 13678-59-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-(6-heptynyl)-1,3-dioxolane

Formula: C10H16O2
Exact Mass: 168.115
Source ID: CNP0082082.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-nitrophenyl 1-naphthoate

Formula: C17H11NO4
Exact Mass: 293.0688
Source ID: CNP0602806.0
  • CAS Registry: 65426-83-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,3-Diacetylpropane

Formula: C7H12O2
Exact Mass: 128.0837
Source ID: CNP0084433.0
  • CAS Registry: 13505-34-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
S-Methyl butanethioate

Formula: C5H10OS
Exact Mass: 118.0452
Source ID: CNP0084452.0
  • CAS Registry: 2432-51-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3b-Hydroxy-5-cholenoic acid

Formula: C24H38O3
Exact Mass: 374.2821
Source ID: CNP0259738.2
  • CAS Registry: 5255-17-4
  • KEGG:
  • LipidMAPS: LMST04010201
  • BioCYC:
13,14-Dihydro PGE1

Formula: C20H36O5
Exact Mass: 356.2563
Source ID: CNP0185236.1
  • CAS Registry: 19313-28-1
  • KEGG:
  • LipidMAPS: LMFA03010144
  • BioCYC:
3-Hydroxyfluorene

Formula: C13H10O
Exact Mass: 182.0732
Source ID: CNP0314999.0
  • CAS Registry: 6344-67-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Methyl (methylthio)methyl disulfide

Formula: C3H8S3
Exact Mass: 139.9788
Source ID: CNP0313036.0
  • CAS Registry: 42474-44-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5alpha-Tetrahydrocortisol

Formula: C21H34O5
Exact Mass: 366.2406
Source ID: CNP0177674.1
  • CAS Registry: 302-91-0
  • KEGG:
  • LipidMAPS: LMST02030200
  • BioCYC:
Tyramine

Formula: C8H11NO
Exact Mass: 137.0841
Source ID: CNP0290010.0
  • CAS Registry: 51-67-2
  • KEGG: C00483
  • LipidMAPS:
  • BioCYC: TYRAMINE
4-Methoxytyramine

Formula: C9H13NO2
Exact Mass: 167.0946
Source ID: CNP0246187.0
  • CAS Registry: 3213-30-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Prostaglandin J2

Formula: C20H30O4
Exact Mass: 334.2144
Source ID: CNP0339189.1
  • CAS Registry: 60203-57-8
  • KEGG: C05957
  • LipidMAPS: LMFA03010019
  • BioCYC:
2-Oxoadipate

Formula: C6H8O5
Exact Mass: 160.0372
Source ID: CNP0300956.0
  • CAS Registry: 3184-35-8
  • KEGG: C00322
  • LipidMAPS: LMFA01170121
  • BioCYC:
O-Phospho-L-serine

Formula: C3H8NO6P
Exact Mass: 185.0089
Source ID: CNP0263057.1
  • CAS Registry: 407-41-0
  • KEGG: C01005
  • LipidMAPS:
  • BioCYC: 3-P-SERINE
Ecgonine methyl ester

Formula: C10H17NO3
Exact Mass: 199.1208
Source ID: CNP0176199.1
  • CAS Registry: 7143-09-1
  • KEGG: C12448
  • LipidMAPS:
  • BioCYC:
Ethyl cyclohexanecarboxylate

Formula: C9H16O2
Exact Mass: 156.115
Source ID: CNP0408576.0
  • CAS Registry: 3289-28-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Methoxy-17beta-estradiol

Formula: C19H26O3
Exact Mass: 302.1882
Source ID: CNP0083504.1
  • CAS Registry: 362-07-2
  • KEGG: C05302
  • LipidMAPS: LMST02010035
  • BioCYC: 2-METHOXY-ESTRADIOL-17B
5,6-Dihydroxyindole-2-carboxylate

Formula: C9H7NO4
Exact Mass: 193.0375
Source ID: CNP0083678.0
  • CAS Registry: 4790-08-3
  • KEGG: C04185
  • LipidMAPS:
  • BioCYC:
3,4-Methylene suberic acid

Formula: C10H14O4
Exact Mass: 198.0892
Source ID: CNP0308260.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Androsterone sulfate

Formula: C19H30O5S
Exact Mass: 370.1814
Source ID: CNP0150597.1
  • CAS Registry: 2479-86-9
  • KEGG: C04555
  • LipidMAPS: LMST05020001
  • BioCYC:
12(S)-HPETE

Formula: C20H32O4
Exact Mass: 336.23
Source ID: CNP0083637.2
  • CAS Registry: 71774-10-2
  • KEGG: C05965
  • LipidMAPS: LMFA03060013
  • BioCYC:
5-Hydroxyindoleacetaldehyde

Formula: C10H9NO2
Exact Mass: 175.0633
Source ID: CNP0243856.0
  • CAS Registry: 1892-21-3
  • KEGG: C05634
  • LipidMAPS:
  • BioCYC: 5-HYDROXYINDOLE_ACETALDEHYDE
5-Methylfuran-2-carboxylic acid

Formula: C6H6O3
Exact Mass: 126.0317
Source ID: CNP0084070.0
  • CAS Registry: 1917-15-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3,4-Methyleneazelaic acid

Formula: C11H16O4
Exact Mass: 212.1049
Source ID: CNP0084085.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Acetoacetate

Formula: C4H6O3
Exact Mass: 102.0317
Source ID: CNP0286292.0
  • CAS Registry: 541-50-4
  • KEGG: C00164
  • LipidMAPS: LMFA01060003
  • BioCYC: 3-KETOBUTYRATE
4-Acetamidobutanoate

Formula: C6H11NO3
Exact Mass: 145.0739
Source ID: CNP0201600.0
  • CAS Registry: 3025-96-5
  • KEGG: C02946
  • LipidMAPS:
  • BioCYC:
Uroporphyrin III

Formula: C40H38N4O16
Exact Mass: 830.2283
Source ID: CNP0082950.0
  • CAS Registry: 18273-06-8
  • KEGG: C02469
  • LipidMAPS:
  • BioCYC:
CO

Formula: CO
Exact Mass: 27.9949
Source ID: CNP0572564.0
  • CAS Registry: 630-08-0
  • KEGG: C00237
  • LipidMAPS:
  • BioCYC: CARBON-MONOXIDE
CE 18:3

Formula: C45H74O2
Exact Mass: 646.5689
Source ID: CNP0235944.1
  • CAS Registry: 2545-22-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Triethylene Glycol Monomethyl Ether

Formula: C7H16O4
Exact Mass: 164.1049
Source ID: CNP0413334.0
  • CAS Registry: 112-35-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Methoxy-4-methylbenzene

Formula: C8H10O
Exact Mass: 122.0732
Source ID: CNP0160002.0
  • CAS Registry: 104-93-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Betaine aldehyde

Formula: C5H12NO
Exact Mass: 102.0919
Source ID: CNP0578871.0
  • CAS Registry: 7418-61-3
  • KEGG: C00576
  • LipidMAPS:
  • BioCYC: BETAINE_ALDEHYDE
diethyl(propyl)amine

Formula: C7H17N
Exact Mass: 115.1361
Source ID: CNP0172466.0
  • CAS Registry: 4458-31-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Dehydroalanine

Formula: C3H5NO2
Exact Mass: 87.032
Source ID: CNP0224979.0
  • CAS Registry: 1948-56-7
  • KEGG: C02218
  • LipidMAPS:
  • BioCYC: 2-AMINOACRYLATE
10-Undecen-1-ol

Formula: C11H22O
Exact Mass: 170.1671
Source ID: CNP0216447.0
  • CAS Registry: 112-43-6
  • KEGG:
  • LipidMAPS: LMFA05000587
  • BioCYC:
2-[2-(2-methoxyethoxy)ethoxy]-1,3-dioxolane

Formula: C8H16O5
Exact Mass: 192.0998
Source ID: CNP0082086.0
  • CAS Registry: 74733-99-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Prostaglandin D2

Formula: C20H32O5
Exact Mass: 352.225
Source ID: CNP0323187.1
  • CAS Registry: 41598-07-6
  • KEGG: C00696
  • LipidMAPS: LMFA03010004
  • BioCYC:
Estradiol-17beta 3-glucuronide

Formula: C24H32O8
Exact Mass: 448.2097
Source ID: CNP0175579.1
  • CAS Registry: 15270-30-1
  • KEGG: C05503
  • LipidMAPS: LMST05010007
  • BioCYC:
Parabanic Acid

Formula: C3H2N2O3
Exact Mass: 114.0065
Source ID: CNP0516819.0
  • CAS Registry: 120-89-8
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-3685
LPC 18:0

Formula: C26H54NO7P
Exact Mass: 523.3638
Source ID: CNP0520254.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Aminoacetone

Formula: C3H7NO
Exact Mass: 73.0528
Source ID: CNP0602829.0
  • CAS Registry: 298-08-8
  • KEGG: C01888
  • LipidMAPS:
  • BioCYC:
ADENOSINE 3',5'-DIPHOSPHATE

Formula: C10H15N5O10P2
Exact Mass: 427.0294
Source ID: CNP0238170.1
  • CAS Registry: 75431-54-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
D-Fructose 6-phosphate

Formula: C6H13O9P
Exact Mass: 260.0297
Source ID: CNP0330102.2
  • CAS Registry: 643-13-0
  • KEGG: C00085
  • LipidMAPS:
  • BioCYC: CPD-15709
gamma-L-Glutamyl-L-cysteine

Formula: C8H14N2O5S
Exact Mass: 250.0623
Source ID: CNP0201590.1
  • CAS Registry: 636-58-8
  • KEGG: C00669
  • LipidMAPS:
  • BioCYC: L-GAMMA-GLUTAMYLCYSTEINE
12-HEPE

Formula: C20H30O3
Exact Mass: 318.2195
Source ID: CNP0124177.1
  • CAS Registry: 81187-21-5
  • KEGG:
  • LipidMAPS: LMFA03070031
  • BioCYC:
Methyl cyclohexanecarboxylate

Formula: C8H14O2
Exact Mass: 142.0994
Source ID: CNP0393903.0
  • CAS Registry: 4630-82-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tetrahydrocorticosterone

Formula: C21H34O4
Exact Mass: 350.2457
Source ID: CNP0228137.2
  • CAS Registry: 68-42-8
  • KEGG: C05476
  • LipidMAPS: LMST02030100
  • BioCYC:
Bis(2-methylundecan-2-yl) Disulfide

Formula: C24H50S2
Exact Mass: 402.3354
Source ID: CNP0082475.0
  • CAS Registry: 27458-90-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-S-cysteinyl-DOPA

Formula: C12H16N2O6S
Exact Mass: 316.0729
Source ID: CNP0291264.1
  • CAS Registry: 25565-17-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,5-S,S'-dicysteinyldopa

Formula: C15H21N3O8S2
Exact Mass: 435.077
Source ID: CNP0166356.1
  • CAS Registry: 57954-84-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-methylene-1,4-butanediol

Formula: C5H10O2
Exact Mass: 102.0681
Source ID: CNP0082069.0
  • CAS Registry: 55881-94-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
O-Desmethylnaproxen

Formula: C13H12O3
Exact Mass: 216.0786
Source ID: CNP0352675.1
  • CAS Registry: 52079-10-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Methylcyclohexanol

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0084309.0
  • CAS Registry: 590-67-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Hydroxydopamine

Formula: C8H11NO3
Exact Mass: 169.0739
Source ID: CNP0084304.0
  • CAS Registry: 1927-04-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tauroursodeoxycholic acid

Formula: C26H45NO6S
Exact Mass: 499.2967
Source ID: CNP0190418.3
  • CAS Registry: 14605-22-2
  • KEGG: C16868
  • LipidMAPS: LMST05040015
  • BioCYC: CPD-18799
N-Acetylcadaverine

Formula: C7H16N2O
Exact Mass: 144.1263
Source ID: CNP0366211.0
  • CAS Registry: 32343-73-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Myristoylglycine

Formula: C16H31NO3
Exact Mass: 285.2304
Source ID: CNP0364014.0
  • CAS Registry: 14246-55-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,1,3,3-tetramethylurea

Formula: C5H12N2O
Exact Mass: 116.095
Source ID: CNP0083044.0
  • CAS Registry: 632-22-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pantetheine

Formula: C11H22N2O4S
Exact Mass: 278.13
Source ID: CNP0332663.1
  • CAS Registry: 496-65-1
  • KEGG: C00831
  • LipidMAPS:
  • BioCYC: CPD-511
N(6),N(6),N(6)-trimethyl-L-lysine

Formula: C9H21N2O2
Exact Mass: 189.1603
Source ID: CNP0599940.1
  • CAS Registry: 19253-88-4
  • KEGG: C03793
  • LipidMAPS:
  • BioCYC: N6N6N6-TRIMETHYL-L-LYSINE
6-amino-5[N-methylformylamino]-1-methyluracil

Formula: C7H10N4O3
Exact Mass: 198.0753
Source ID: CNP0084101.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
S-3-oxodecanoyl cysteamine

Formula: C12H23NO2S
Exact Mass: 245.1449
Source ID: CNP0084103.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cortolone

Formula: C21H34O5
Exact Mass: 366.2406
Source ID: CNP0192522.1
  • CAS Registry: 516-42-7
  • KEGG: C05481
  • LipidMAPS: LMST02030227
  • BioCYC: CORTOLONE
3alpha,17alpha,21-Trihydroxy-5beta-pregnan-20-one

Formula: C21H34O4
Exact Mass: 350.2457
Source ID: CNP0164451.1
  • CAS Registry: 68-60-0
  • KEGG: C14594
  • LipidMAPS: LMST05030014
  • BioCYC:
4-Aminohippuric acid

Formula: C9H10N2O3
Exact Mass: 194.0691
Source ID: CNP0336152.0
  • CAS Registry: 61-78-9
  • KEGG: D06890
  • LipidMAPS:
  • BioCYC:
Bisphenol A

Formula: C15H16O2
Exact Mass: 228.115
Source ID: CNP0082073.0
  • CAS Registry: 80-05-7
  • KEGG: C13624
  • LipidMAPS:
  • BioCYC: CPD-18833
1,3,5-pentanetriol

Formula: C5H12O3
Exact Mass: 120.0786
Source ID: CNP0198973.0
  • CAS Registry: 4328-94-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5beta-Pregnane-3,20-dione

Formula: C21H32O2
Exact Mass: 316.2402
Source ID: CNP0201363.2
  • CAS Registry: 128-23-4
  • KEGG: C05479
  • LipidMAPS: LMST02030146
  • BioCYC:
4alpha-Methylzymosterol

Formula: C28H46O
Exact Mass: 398.3548
Source ID: CNP0291023.1
  • CAS Registry: 7448-03-5
  • KEGG: C05103
  • LipidMAPS: LMST01010202
  • BioCYC: 4-METHYL-824-CHOLESTADIENOL
Androsterone sulfate

Formula: C19H30O5S
Exact Mass: 370.1814
Source ID: CNP0150597.2
  • CAS Registry: 2479-86-9
  • KEGG: C04555
  • LipidMAPS: LMST05020001
  • BioCYC:
Picolinoylglycine

Formula: C8H8N2O3
Exact Mass: 180.0535
Source ID: CNP0247858.0
  • CAS Registry: 5616-29-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Ophthalmic acid

Formula: C11H19N3O6
Exact Mass: 289.1274
Source ID: CNP0143579.1
  • CAS Registry: 495-27-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Ethyl-3,5-diisopropyl-benzene

Formula: C14H22
Exact Mass: 190.1721
Source ID: CNP0084073.0
  • CAS Registry: 15181-13-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Sphingosine 1-phosphate

Formula: C18H38NO5P
Exact Mass: 379.2487
Source ID: CNP0375659.1
  • CAS Registry: 26993-30-6
  • KEGG: C06124
  • LipidMAPS: LMSP01050001
  • BioCYC:
Corticosterone

Formula: C21H30O4
Exact Mass: 346.2144
Source ID: CNP0221293.2
  • CAS Registry: 50-22-6
  • KEGG: C02140
  • LipidMAPS: LMST02030186
  • BioCYC: CORTICOSTERONE
Delta1-Piperideine-2-carboxylate

Formula: C6H9NO2
Exact Mass: 127.0633
Source ID: CNP0002372.0
  • CAS Registry: 2756-89-0
  • KEGG: C04092
  • LipidMAPS:
  • BioCYC:
Testosterone acetate

Formula: C21H30O3
Exact Mass: 330.2195
Source ID: CNP0273731.1
  • CAS Registry: 1045-69-8
  • KEGG: C03027
  • LipidMAPS: LMST02020057
  • BioCYC: CPD-271
5beta-Cholestan-3-one

Formula: C27H46O
Exact Mass: 386.3548
Source ID: CNP0286327.2
  • CAS Registry: 601-53-6
  • KEGG: C03091
  • LipidMAPS: LMST01010205
  • BioCYC: CPD-1082
Naproxen

Formula: C14H14O3
Exact Mass: 230.0943
Source ID: CNP0274058.2
  • CAS Registry: 22204-53-1
  • KEGG: C01517
  • LipidMAPS:
  • BioCYC:
1-Methyl-3-(2-methyl-2-propenyl)-cyclopentane

Formula: C10H18
Exact Mass: 138.1408
Source ID: CNP0211538.0
  • CAS Registry: 75873-00-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C20H32O5
Exact Mass: 352.225
Source ID: CNP0082182.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Methylglutaric acid

Formula: C6H10O4
Exact Mass: 146.0579
Source ID: CNP0184293.0
  • CAS Registry: 617-62-9
  • KEGG: C05282
  • LipidMAPS: LMFA01170084
  • BioCYC:
PC(22:5(4Z,7Z,10Z,13Z,16Z)/P-16:0)

Formula: C46H82NO7P
Exact Mass: 791.5829
Source ID: CNP0484266.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE


Formula: C57H104O6
Exact Mass: 884.7832
Source ID: CNP0246905.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C22H34O3
Exact Mass: 346.2508
Source ID: CNP0081797.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(20:2(11Z,14Z)/P-16:0)

Formula: C44H84NO7P
Exact Mass: 769.5985
Source ID: CNP0584459.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:3(5Z,8Z,11Z)/P-18:0)

Formula: C46H86NO7P
Exact Mass: 795.6142
Source ID: CNP0500038.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:3(5Z,8Z,11Z)/P-16:0)

Formula: C44H82NO7P
Exact Mass: 767.5829
Source ID: CNP0591474.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:3(5Z,8Z,11Z)/P-18:1(9Z))

Formula: C46H84NO7P
Exact Mass: 793.5985
Source ID: CNP0597169.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
4-Hydroxyisovaleric acid

Formula: C5H10O3
Exact Mass: 118.063
Source ID: CNP0350905.0
  • CAS Registry: 77220-86-1
  • KEGG:
  • LipidMAPS: LMFA01050399
  • BioCYC:
Leukotriene E4

Formula: C23H37NO5S
Exact Mass: 439.2392
Source ID: CNP0228382.1
  • CAS Registry: 75715-89-8
  • KEGG: C05952
  • LipidMAPS: LMFA03020002
  • BioCYC:
Coproporphyrinogen I

Formula: C36H44N4O8
Exact Mass: 660.3159
Source ID: CNP0085684.0
  • CAS Registry: 31110-56-2
  • KEGG: C05768
  • LipidMAPS:
  • BioCYC:
Leukotriene D4

Formula: C25H40N2O6S
Exact Mass: 496.2607
Source ID: CNP0559948.1
  • CAS Registry: 73836-78-9
  • KEGG: C05951
  • LipidMAPS: LMFA03020006
  • BioCYC:
3-Sulfopyruvate

Formula: C3H4O6S
Exact Mass: 167.9729
Source ID: CNP0249927.0
  • CAS Registry: 98022-26-5
  • KEGG: C05528
  • LipidMAPS:
  • BioCYC:
2,7,7-Trimethyl-bicyclo[2.2.1]hept-2-ene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0135245.0
  • CAS Registry: 514-14-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Diethylthiophosphoric acid

Formula: C4H11O3PS
Exact Mass: 170.0167
Source ID: CNP0083541.0
  • CAS Registry: 5871-17-0
  • KEGG: C06607
  • LipidMAPS:
  • BioCYC:
N-[3-(4-\{[1-(5-chloro-2,4-dimethoxyanilino)-1-oxopropan-2-yl]sulfanyl\}anilino)-3-oxo-1-phenylprop-1-en-2-yl]benzamide

Formula: C33H30ClN3O5S
Exact Mass: 615.1595
Source ID: CNP0082155.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Acetyl phosphate

Formula: C2H5O5P
Exact Mass: 139.9875
Source ID: CNP0284907.0
  • CAS Registry: 590-54-5
  • KEGG: C00227
  • LipidMAPS:
  • BioCYC:
DTXSID901102573

Formula: C57H86O3
Exact Mass: 818.6577
Source ID: CNP0339254.0
  • CAS Registry: 7200-30-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Decaprenyl-6-methoxyphenol

Formula: C57H88O2
Exact Mass: 804.6784
Source ID: CNP0228942.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Arsenocholine

Formula: C5H14AsO
Exact Mass: 165.0261
Source ID: CNP0083842.0
  • CAS Registry: 39895-81-3
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-23518
PC(18:3(9Z,12Z,15Z)/P-18:1(9Z))

Formula: C44H80NO7P
Exact Mass: 765.5672
Source ID: CNP0593812.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(24:1(15Z)/P-18:1(9Z))

Formula: C50H96NO7P
Exact Mass: 853.6924
Source ID: CNP0560823.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:3(9Z,12Z,15Z)/P-16:0)

Formula: C42H78NO7P
Exact Mass: 739.5516
Source ID: CNP0578866.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(24:1(15Z)/P-18:0)

Formula: C50H98NO7P
Exact Mass: 855.7081
Source ID: CNP0577376.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:4(6Z,9Z,12Z,15Z)/P-16:0)

Formula: C42H76NO7P
Exact Mass: 737.5359
Source ID: CNP0596884.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(24:1(15Z)/P-18:1(11Z))

Formula: C50H96NO7P
Exact Mass: 853.6924
Source ID: CNP0508534.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
alpha-Trichloromethylbenzyl acetate

Formula: C10H9Cl3O2
Exact Mass: 265.9668
Source ID: CNP0084848.0
  • CAS Registry: 90-17-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(22:5(7Z,10Z,13Z,16Z,19Z)/P-16:0)

Formula: C46H82NO7P
Exact Mass: 791.5829
Source ID: CNP0541495.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
Glycerol 1,3-dihexadecanoate

Formula: C35H68O5
Exact Mass: 568.5066
Source ID: CNP0286764.1
  • CAS Registry: 502-52-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Prostaglandin F2beta

Formula: C20H34O5
Exact Mass: 354.2406
Source ID: CNP0248684.3
  • CAS Registry: 4510-16-1
  • KEGG: C02314
  • LipidMAPS: LMFA03010025
  • BioCYC:
11-epi-Prostaglandin F2alpha

Formula: C20H34O5
Exact Mass: 354.2406
Source ID: CNP0248684.4
  • CAS Registry: 38432-87-0
  • KEGG: C05959
  • LipidMAPS: LMFA03010036
  • BioCYC:
Androsterone glucuronide

Formula: C25H38O8
Exact Mass: 466.2567
Source ID: CNP0123221.3
  • CAS Registry: 1852-43-3
  • KEGG: C11135
  • LipidMAPS: LMST05010013
  • BioCYC:
PC(20:2(11Z,14Z)/P-18:1(11Z))

Formula: C46H86NO7P
Exact Mass: 795.6142
Source ID: CNP0493872.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(20:3(5Z,8Z,11Z)/P-18:1(11Z))

Formula: C46H84NO7P
Exact Mass: 793.5985
Source ID: CNP0578856.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
Pentenedioic acid

Formula: C5H6O4
Exact Mass: 130.0266
Source ID: CNP0111503.0
  • CAS Registry: 1724-02-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Ethyl-4-methyl-1-pentanol

Formula: C8H18O
Exact Mass: 130.1358
Source ID: CNP0084487.0
  • CAS Registry: 106-67-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C20H30O3
Exact Mass: 318.2195
Source ID: CNP0237753.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,3-DIMETHYL-2-PENTENE

Formula: C7H14
Exact Mass: 98.1095
Source ID: CNP0120515.0
  • CAS Registry: 26232-98-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
14-oxo-DoHE(1-)

Formula: C22H30O3
Exact Mass: 342.2195
Source ID: CNP0371042.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methyl-1-penten-3-ol

Formula: C6H12O
Exact Mass: 100.0888
Source ID: CNP0352178.0
  • CAS Registry: 918-85-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C18H32O4
Exact Mass: 312.23
Source ID: CNP0084951.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
9-HOTE

Formula: C18H30O3
Exact Mass: 294.2195
Source ID: CNP0084953.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-Acetylvanilalanine

Formula: C12H15NO5
Exact Mass: 253.095
Source ID: CNP0084972.0
  • CAS Registry: 63357-45-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C18H32O4
Exact Mass: 312.23
Source ID: CNP0386665.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tiglylcarnitine

Formula: C12H21NO4
Exact Mass: 243.1471
Source ID: CNP0595723.0
  • CAS Registry: 64681-36-3
  • KEGG:
  • LipidMAPS: LMFA07070108
  • BioCYC:
2-Methylbutyroylcarnitine

Formula: C12H23NO4
Exact Mass: 245.1627
Source ID: CNP0082618.0
  • CAS Registry: 31023-25-3
  • KEGG:
  • LipidMAPS: LMFA07070034
  • BioCYC:
Succinylcarnitine

Formula: C11H19NO6
Exact Mass: 261.1212
Source ID: CNP0521480.0
  • CAS Registry: 256928-74-2
  • KEGG:
  • LipidMAPS: LMFA07070101
  • BioCYC:
Cer(d18:1/18:0)

Formula: C36H71NO3
Exact Mass: 565.5434
Source ID: CNP0172298.1
  • CAS Registry: 2304-81-6
  • KEGG: C00195
  • LipidMAPS: LMSP02010006
  • BioCYC:
9-Decenoylcarnitine

Formula: C17H31NO4
Exact Mass: 313.2253
Source ID: CNP0542041.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMFA07070048
  • BioCYC:
PS(18:0/18:1(9Z))

Formula: C42H80NO10P
Exact Mass: 789.552
Source ID: CNP0118740.1
  • CAS Registry: 124262-93-7
  • KEGG: C02737
  • LipidMAPS: LMGP03010025
  • BioCYC: CPD-8336
3-O-Methyl-a-methyldopa

Formula: C10H13NO4
Exact Mass: 211.0845
Source ID: CNP0192186.1
  • CAS Registry: 300-48-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Ethylhydracrylic acid

Formula: C5H10O3
Exact Mass: 118.063
Source ID: CNP0245703.0
  • CAS Registry: 4374-62-3
  • KEGG:
  • LipidMAPS: LMFA01050388
  • BioCYC:
4-ethylphenyl sulfate

Formula: C8H10O4S
Exact Mass: 202.03
Source ID: CNP0276376.0
  • CAS Registry: 85734-98-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
13-hydroxytetradecanoic acid

Formula: C14H28O3
Exact Mass: 244.2038
Source ID: CNP0081935.0
  • CAS Registry: 17278-73-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C22H32O3
Exact Mass: 344.2351
Source ID: CNP0081803.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C22H34O3
Exact Mass: 346.2508
Source ID: CNP0081800.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C18H33NO3
Exact Mass: 311.246
Source ID: CNP0081796.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(+/-)19(20)-EpDTE

Formula: C22H34O3
Exact Mass: 346.2508
Source ID: CNP0257865.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMFA04000111
  • BioCYC:


Formula: C22H32O3
Exact Mass: 344.2351
Source ID: CNP0216054.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C22H34O3
Exact Mass: 346.2508
Source ID: CNP0370194.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C20H34O3
Exact Mass: 322.2508
Source ID: CNP0081946.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C22H34O3
Exact Mass: 346.2508
Source ID: CNP0081798.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C22H32O3
Exact Mass: 344.2351
Source ID: CNP0130499.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C20H34O3
Exact Mass: 322.2508
Source ID: CNP0081947.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
TG(18:2(9Z,12Z)/18:1(9Z)/18:3(9Z,12Z,15Z))

Formula: C57H98O6
Exact Mass: 878.7363
Source ID: CNP0301451.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Ethyl isobutyl ketone

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0284484.0
  • CAS Registry: 623-56-3
  • KEGG:
  • LipidMAPS: LMFA12000088
  • BioCYC:
PC(20:2(11Z,14Z)/P-18:1(9Z))

Formula: C46H86NO7P
Exact Mass: 795.6142
Source ID: CNP0581534.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
(E)-3-decen-1-ol

Formula: C10H20O
Exact Mass: 156.1514
Source ID: CNP0105271.0
  • CAS Registry: 10339-60-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Octenedioic acid

Formula: C8H12O4
Exact Mass: 172.0736
Source ID: CNP0084482.0
  • CAS Registry: 5698-50-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Hydroxyadipic acid

Formula: C6H10O5
Exact Mass: 162.0528
Source ID: CNP0084473.0
  • CAS Registry: 14292-29-6
  • KEGG:
  • LipidMAPS: LMFA01170088
  • BioCYC:
3-Phosphonooxypyruvate

Formula: C3H5O7P
Exact Mass: 183.9773
Source ID: CNP0359853.0
  • CAS Registry: 3913-50-6
  • KEGG: C03232
  • LipidMAPS:
  • BioCYC:
2H-1-Benzopyran-2-one, 7-(sulfooxy)-

Formula: C9H6O6S
Exact Mass: 241.9885
Source ID: CNP0083023.0
  • CAS Registry: 69526-88-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tyramine-O-sulfate

Formula: C8H11NO4S
Exact Mass: 217.0409
Source ID: CNP0083024.0
  • CAS Registry: 30223-92-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Hydroxy-2-oxoglutarate

Formula: C5H6O6
Exact Mass: 162.0164
Source ID: CNP0002358.0
  • CAS Registry: 1187-99-1
  • KEGG: C01127
  • LipidMAPS:
  • BioCYC:
L-2-Aminoadipate 6-semialdehyde

Formula: C6H11NO3
Exact Mass: 145.0739
Source ID: CNP0258672.1
  • CAS Registry: 6665-12-9
  • KEGG: C04076
  • LipidMAPS:
  • BioCYC: ALLYSINE
2-Amino-3-oxoadipate

Formula: C6H9NO5
Exact Mass: 175.0481
Source ID: CNP0083534.0
  • CAS Registry:
  • KEGG: C05520
  • LipidMAPS: LMFA01100036
  • BioCYC:
S-Glutaryldihydrolipoamide

Formula: C13H23NO4S2
Exact Mass: 321.1068
Source ID: CNP0083527.0
  • CAS Registry:
  • KEGG: C06157
  • LipidMAPS:
  • BioCYC:
PC(P-16:0/22:4(7Z,10Z,13Z,16Z))

Formula: C46H84NO7P
Exact Mass: 793.5985
Source ID: CNP0601576.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMGP01030045
  • BioCYC:
p-Hydroxyphenylacetylglycine

Formula: C10H11NO4
Exact Mass: 209.0688
Source ID: CNP0084910.0
  • CAS Registry: 28116-23-6
  • KEGG: C05596
  • LipidMAPS:
  • BioCYC:
1-Methyl-3-(2-methyl-1-propenyl)cyclopentane

Formula: C10H18
Exact Mass: 138.1408
Source ID: CNP0182372.0
  • CAS Registry: 75873-01-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(Z)-But-2-ene-1,2,3-tricarboxylate

Formula: C7H8O6
Exact Mass: 188.0321
Source ID: CNP0152616.0
  • CAS Registry: 6061-93-4
  • KEGG: C04225
  • LipidMAPS:
  • BioCYC:
N-Methylethanolamine phosphate

Formula: C3H10NO4P
Exact Mass: 155.0347
Source ID: CNP0449084.0
  • CAS Registry: 6909-61-1
  • KEGG: C01210
  • LipidMAPS:
  • BioCYC:
2-Phosphoglycolate

Formula: C2H5O6P
Exact Mass: 155.9824
Source ID: CNP0359504.0
  • CAS Registry: 13147-57-4
  • KEGG: C00988
  • LipidMAPS:
  • BioCYC:
2-Methyl-3-phenyl-2-propenal

Formula: C10H10O
Exact Mass: 146.0732
Source ID: CNP0107200.0
  • CAS Registry: 101-39-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
10-Methyltridecanoic acid

Formula: C14H28O2
Exact Mass: 228.2089
Source ID: CNP0227243.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Decenal

Formula: C10H18O
Exact Mass: 154.1358
Source ID: CNP0153870.0
  • CAS Registry: 30390-50-2
  • KEGG:
  • LipidMAPS: LMFA06000147
  • BioCYC:
Diethylphosphoric acid

Formula: C4H11O4P
Exact Mass: 154.0395
Source ID: CNP0088182.0
  • CAS Registry: 598-02-7
  • KEGG: C06608
  • LipidMAPS:
  • BioCYC:
Parathion

Formula: C10H14NO5PS
Exact Mass: 291.033
Source ID: CNP0580221.0
  • CAS Registry: 56-38-2
  • KEGG: C06604
  • LipidMAPS:
  • BioCYC: PARATHION
1D-5-O-Methyl-chiro-inositol

Formula: C7H14O6
Exact Mass: 194.079
Source ID: CNP0201870.24
  • CAS Registry: 3564-07-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
ochratoxin alpha

Formula: C11H9ClO5
Exact Mass: 256.0138
Source ID: CNP0116154.1
  • CAS Registry: 19165-63-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PC(18:3(9Z,12Z,15Z)/P-18:0)

Formula: C44H82NO7P
Exact Mass: 767.5829
Source ID: CNP0593621.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
Thiamin monophosphate

Formula: C12H18N4O4PS
Exact Mass: 345.0786
Source ID: CNP0591993.0
  • CAS Registry: 495-23-8
  • KEGG: C01081
  • LipidMAPS:
  • BioCYC:
Cystathionine

Formula: C7H14N2O4S
Exact Mass: 222.0674
Source ID: CNP0172506.2
  • CAS Registry: 535-34-2
  • KEGG: C00542
  • LipidMAPS:
  • BioCYC: CPD0-1563
PC(18:4(6Z,9Z,12Z,15Z)/P-18:1(11Z))

Formula: C44H78NO7P
Exact Mass: 763.5516
Source ID: CNP0575121.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:4(6Z,9Z,12Z,15Z)/P-18:1(9Z))

Formula: C44H78NO7P
Exact Mass: 763.5516
Source ID: CNP0571297.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
5-Tetradecenoic acid

Formula: C14H26O2
Exact Mass: 226.1933
Source ID: CNP0243360.0
  • CAS Registry: 5684-69-5
  • KEGG:
  • LipidMAPS: LMFA01030913
  • BioCYC:
PC(18:3(9Z,12Z,15Z)/P-18:1(11Z))

Formula: C44H80NO7P
Exact Mass: 765.5672
Source ID: CNP0541205.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
PC(18:4(6Z,9Z,12Z,15Z)/P-18:0)

Formula: C44H80NO7P
Exact Mass: 765.5672
Source ID: CNP0518749.0
  • CAS Registry:
  • KEGG: C00157
  • LipidMAPS:
  • BioCYC: PHOSPHATIDYLCHOLINE
L-Erythrulose

Formula: C4H8O4
Exact Mass: 120.0423
Source ID: CNP0200270.1
  • CAS Registry: 533-50-6
  • KEGG: C02045
  • LipidMAPS:
  • BioCYC: ERYTHRULOSE
Tolbutamide

Formula: C12H18N2O3S
Exact Mass: 270.1038
Source ID: CNP0480646.0
  • CAS Registry: 64-77-7
  • KEGG: C07148
  • LipidMAPS:
  • BioCYC: CPD-20634
Bis(5'-adenosyl) pentaphosphate

Formula: C20H29N10O22P5
Exact Mass: 916.0146
Source ID: CNP0082870.1
  • CAS Registry: 41708-91-2
  • KEGG: C04058
  • LipidMAPS:
  • BioCYC:
S-(2-Methylbutanoyl)-dihydrolipoamide

Formula: C13H25NO2S2
Exact Mass: 291.1327
Source ID: CNP0082875.0
  • CAS Registry:
  • KEGG: C05118
  • LipidMAPS:
  • BioCYC: CPD-941
3-methoxy-4-hydroxy-5-all-trans-decaprenylbenzoate

Formula: C58H88O4
Exact Mass: 848.6682
Source ID: CNP0171263.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C57H86O4
Exact Mass: 834.6526
Source ID: CNP0138361.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C58H88O3
Exact Mass: 832.6733
Source ID: CNP0267478.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pristanal

Formula: C19H38O
Exact Mass: 282.2922
Source ID: CNP0362657.0
  • CAS Registry: 105373-75-9
  • KEGG:
  • LipidMAPS: LMPR0104010012
  • BioCYC: CPD-14674
S-Acetyldihydrolipoamide

Formula: C10H19NO2S2
Exact Mass: 249.0857
Source ID: CNP0082927.0
  • CAS Registry:
  • KEGG: C01136
  • LipidMAPS: LMFA08010023
  • BioCYC:
S-(2-Methylpropanoyl)-dihydrolipoamide

Formula: C12H23NO2S2
Exact Mass: 277.117
Source ID: CNP0082917.0
  • CAS Registry: 958734-24-2
  • KEGG: C04424
  • LipidMAPS: LMFA08010022
  • BioCYC: CPD-281
Coproporphyrin III

Formula: C36H38N4O8
Exact Mass: 654.269
Source ID: CNP0082890.0
  • CAS Registry: 14643-66-4
  • KEGG: C05770
  • LipidMAPS:
  • BioCYC: COPROPORPHYRIN_III
S-(3-Methylbutanoyl)-dihydrolipoamide

Formula: C13H25NO2S2
Exact Mass: 291.1327
Source ID: CNP0152647.0
  • CAS Registry:
  • KEGG: C05119
  • LipidMAPS:
  • BioCYC:
3,3,5-Trimethylheptane

Formula: C10H22
Exact Mass: 142.1721
Source ID: CNP0084850.0
  • CAS Registry: 7154-80-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(Z)-3-Dodecene

Formula: C12H24
Exact Mass: 168.1878
Source ID: CNP0223387.0
  • CAS Registry: 7239-23-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4-Dodecadiene

Formula: C12H22
Exact Mass: 166.1721
Source ID: CNP0241958.0
  • CAS Registry: 35280-32-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Methyl-4-(1-methyl-2-propenyl)-benzene

Formula: C13H18
Exact Mass: 174.1408
Source ID: CNP0336555.0
  • CAS Registry: 14374-92-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
9-Methyldodecanoic acid

Formula: C13H26O2
Exact Mass: 214.1933
Source ID: CNP0278697.0
  • CAS Registry: 223611-75-4
  • KEGG:
  • LipidMAPS: LMFA01020068
  • BioCYC:
1-Methyl-4-(1-methylpropyl)-benzene

Formula: C11H16
Exact Mass: 148.1252
Source ID: CNP0084852.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Ethyl-5-methylfuran

Formula: C7H10O
Exact Mass: 110.0732
Source ID: CNP0251701.0
  • CAS Registry: 1703-52-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
6-Tridecene

Formula: C13H26
Exact Mass: 182.2034
Source ID: CNP0240715.0
  • CAS Registry: 24949-38-0
  • KEGG:
  • LipidMAPS: LMFA11000480
  • BioCYC:
beta-Clovene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0084830.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,4,4-trimethyltricyclo[6.3.1.02,5]dodec-8-ene

Formula: C15H24
Exact Mass: 204.1878
Source ID: CNP0084827.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tetradec-7-ene

Formula: C14H28
Exact Mass: 196.2191
Source ID: CNP0084834.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Eicosadienic acid

Formula: C20H36O2
Exact Mass: 308.2715
Source ID: CNP0281676.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5,20-DIHYDROXYICOSA-6,8,11,14-TETRAENOIC ACID

Formula: C20H32O4
Exact Mass: 336.23
Source ID: CNP0082161.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C20H32O4
Exact Mass: 336.23
Source ID: CNP0192404.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
O-(2-octadecenoyl)carnitine

Formula: C25H47NO4
Exact Mass: 425.3505
Source ID: CNP0570117.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pyrimidine

Formula: C4H4N2
Exact Mass: 80.0374
Source ID: CNP0415803.0
  • CAS Registry: 25247-63-6
  • KEGG: C00396
  • LipidMAPS:
  • BioCYC: PYRIMIDINE-RING
N-Butyrylglycine

Formula: C6H11NO3
Exact Mass: 145.0739
Source ID: CNP0083880.0
  • CAS Registry: 20208-73-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Furoylglycine

Formula: C7H7NO4
Exact Mass: 169.0375
Source ID: CNP0131505.0
  • CAS Registry: 5657-19-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
16-Glucuronide-estriol

Formula: C24H32O9
Exact Mass: 464.2046
Source ID: CNP0191811.1
  • CAS Registry: 1852-50-2
  • KEGG: C05504
  • LipidMAPS: LMST05010008
  • BioCYC:
PC 32:0

Formula: C40H80NO8P
Exact Mass: 733.5621
Source ID: CNP0573129.1
  • CAS Registry: 63-89-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
CE(18:0)

Formula: C45H80O2
Exact Mass: 652.6158
Source ID: CNP0260830.1
  • CAS Registry: 35602-69-8
  • KEGG: C02530
  • LipidMAPS: LMST01020007
  • BioCYC: CPD-21822
LPC 18:1

Formula: C26H52NO7P
Exact Mass: 521.3481
Source ID: CNP0505695.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Aminomalonate

Formula: C3H5NO4
Exact Mass: 119.0219
Source ID: CNP0385563.0
  • CAS Registry: 1068-84-4
  • KEGG: C00872
  • LipidMAPS:
  • BioCYC: AMINOMALONATE
S-Methyl 3-methylthiobutyrate

Formula: C6H12OS
Exact Mass: 132.0609
Source ID: CNP0084338.0
  • CAS Registry: 23747-45-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Coproporphyrin I

Formula: C36H38N4O8
Exact Mass: 654.269
Source ID: CNP0082878.0
  • CAS Registry: 531-14-6
  • KEGG: C05769
  • LipidMAPS:
  • BioCYC:
D-Xylulose

Formula: C5H10O5
Exact Mass: 150.0528
Source ID: CNP0266174.4
  • CAS Registry: 551-84-8
  • KEGG: C00310
  • LipidMAPS:
  • BioCYC: D-XYLULOSE
Testosterone glucuronide

Formula: C25H36O8
Exact Mass: 464.241
Source ID: CNP0222503.1
  • CAS Registry: 1180-25-2
  • KEGG: C11134
  • LipidMAPS: LMST05010012
  • BioCYC:
ADP-mannose

Formula: C16H25N5O15P2
Exact Mass: 589.0822
Source ID: CNP0251613.2
  • CAS Registry: 28447-34-9
  • KEGG: C06192
  • LipidMAPS:
  • BioCYC:
2-Oxoglutaramate

Formula: C5H7NO4
Exact Mass: 145.0375
Source ID: CNP0032107.0
  • CAS Registry: 18465-19-5
  • KEGG: C00940
  • LipidMAPS:
  • BioCYC:
6-Amino-2-oxohexanoate

Formula: C6H11NO3
Exact Mass: 145.0739
Source ID: CNP0416953.0
  • CAS Registry: 10606-14-1
  • KEGG: C03239
  • LipidMAPS:
  • BioCYC: 2-KETO-6-AMINO-CAPROATE
Methanearsonous acid

Formula: CH5AsO2
Exact Mass: 123.9505
Source ID: CNP0579708.0
  • CAS Registry: 25400-23-1
  • KEGG: C07295
  • LipidMAPS:
  • BioCYC: METHYLARSONITE
Uroporphyrin I

Formula: C40H38N4O16
Exact Mass: 830.2283
Source ID: CNP0082894.0
  • CAS Registry: 607-14-7
  • KEGG: C05767
  • LipidMAPS:
  • BioCYC:
2-Quinolinecarboxylic acid

Formula: C10H7NO2
Exact Mass: 173.0477
Source ID: CNP0097420.0
  • CAS Registry: 93-10-7
  • KEGG: C06325
  • LipidMAPS:
  • BioCYC:
4-Trimethylammoniobutanal

Formula: C7H16NO
Exact Mass: 130.1232
Source ID: CNP0530420.0
  • CAS Registry: 64595-66-0
  • KEGG: C01149
  • LipidMAPS:
  • BioCYC: 4-TRIMETHYLAMMONIOBUTANAL
Uroporphyrinogen I

Formula: C40H44N4O16
Exact Mass: 836.2752
Source ID: CNP0083512.0
  • CAS Registry: 1867-62-5
  • KEGG: C05766
  • LipidMAPS:
  • BioCYC: CPD-11444
Gentisate aldehyde

Formula: C7H6O3
Exact Mass: 138.0317
Source ID: CNP0326066.0
  • CAS Registry: 1194-98-5
  • KEGG: C05585
  • LipidMAPS:
  • BioCYC: CPD-16722
Coprocholic acid

Formula: C27H46O5
Exact Mass: 450.3345
Source ID: CNP0158587.1
  • CAS Registry: 547-98-8
  • KEGG: C04722
  • LipidMAPS:
  • BioCYC:
6-Hydroxynicotinate

Formula: C6H5NO3
Exact Mass: 139.0269
Source ID: CNP0320055.0
  • CAS Registry: 5006-66-6
  • KEGG: C01020
  • LipidMAPS:
  • BioCYC:
(20S,24R)-dihydroxyvitamin D3

Formula: C27H44O3
Exact Mass: 416.329
Source ID: CNP0082159.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
L-o-tyrosine

Formula: C9H11NO3
Exact Mass: 181.0739
Source ID: CNP0300752.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
NAD+

Formula: C21H28N7O14P2
Exact Mass: 664.1169
Source ID: CNP0578124.1
  • CAS Registry: 53-84-9
  • KEGG: C00003
  • LipidMAPS:
  • BioCYC:
Prostaglandin D1

Formula: C20H34O5
Exact Mass: 354.2406
Source ID: CNP0200088.1
  • CAS Registry: 17968-82-0
  • KEGG: C06438
  • LipidMAPS: LMFA03010049
  • BioCYC:
2-Hydroxy-3-methylpentanoic acid

Formula: C6H12O3
Exact Mass: 132.0786
Source ID: CNP0290048.1
  • CAS Registry: 488-15-3
  • KEGG:
  • LipidMAPS: LMFA01050380
  • BioCYC:
Cholesteryl arachidonate

Formula: C47H76O2
Exact Mass: 672.5845
Source ID: CNP0206380.1
  • CAS Registry: 604-34-2
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-21830
gamma-Glutamyltyrosine

Formula: C14H18N2O6
Exact Mass: 310.1165
Source ID: CNP0240189.1
  • CAS Registry: 7432-23-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Sulfolithocholylglycine

Formula: C26H43NO7S
Exact Mass: 513.276
Source ID: CNP0266974.1
  • CAS Registry: 15324-64-8
  • KEGG: C11301
  • LipidMAPS: LMST05030004
  • BioCYC:
LysoPC(14:0/0:0)

Formula: C22H46NO7P
Exact Mass: 467.3012
Source ID: CNP0584917.1
  • CAS Registry: 20559-16-4
  • KEGG: C04230
  • LipidMAPS: LMGP01050012
  • BioCYC: CPD-20403
14(R),15(S)-DiHETE

Formula: C20H32O4
Exact Mass: 336.23
Source ID: CNP0112105.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,3-Heptanedione

Formula: C7H12O2
Exact Mass: 128.0837
Source ID: CNP0125705.0
  • CAS Registry: 96-04-8
  • KEGG:
  • LipidMAPS: LMFA12000013
  • BioCYC: CPD-9080
3-Methoxy-4-hydroxyphenylacetaldehyde

Formula: C9H10O3
Exact Mass: 166.063
Source ID: CNP0262632.0
  • CAS Registry: 5703-24-2
  • KEGG: C05581
  • LipidMAPS:
  • BioCYC:
D-Glucuronolactone

Formula: C6H8O6
Exact Mass: 176.0321
Source ID: CNP0190143.1
  • CAS Registry: 32449-92-6
  • KEGG: C02670
  • LipidMAPS:
  • BioCYC: D-GLUCURONOLACTONE
Methylimidazole acetaldehyde

Formula: C6H8N2O
Exact Mass: 124.0637
Source ID: CNP0083533.0
  • CAS Registry: 19639-03-3
  • KEGG: C05827
  • LipidMAPS:
  • BioCYC:
20alpha-Hydroxy-4-pregnen-3-one

Formula: C21H32O2
Exact Mass: 316.2402
Source ID: CNP0323939.1
  • CAS Registry: 145-14-2
  • KEGG: C04042
  • LipidMAPS: LMST02030153
  • BioCYC:
3-Methylene-1,5,5-trimethylcyclohexene

Formula: C10H16
Exact Mass: 136.1252
Source ID: CNP0130960.0
  • CAS Registry: 16609-28-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(S)-3,7-Dimethyl-1,6-octadiene

Formula: C10H18
Exact Mass: 138.1408
Source ID: CNP0168256.2
  • CAS Registry: 10281-55-7
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-23211
2-Hydroxyamino-1-methyl-6-phenylimidazo[4,5-b]pyridine

Formula: C13H12N4O
Exact Mass: 240.1011
Source ID: CNP0180946.0
  • CAS Registry: 124489-20-9
  • KEGG: C20286
  • LipidMAPS:
  • BioCYC:
15(S)-HPETE

Formula: C20H32O4
Exact Mass: 336.23
Source ID: CNP0193711.1
  • CAS Registry: 70981-96-3
  • KEGG: C05966
  • LipidMAPS: LMFA03060014
  • BioCYC:
9(S)-HPODE

Formula: C18H32O4
Exact Mass: 312.23
Source ID: CNP0085561.1
  • CAS Registry: 29774-12-7
  • KEGG: C14827
  • LipidMAPS: LMFA02000012
  • BioCYC: CPD-8677
Cholesterol

Formula: C27H46O
Exact Mass: 386.3548
Source ID: CNP0115532.1
  • CAS Registry: 57-88-5
  • KEGG: C00187
  • LipidMAPS: LMST01010001
  • BioCYC: CHOLESTEROL
11-Dehydro-thromboxane B2

Formula: C20H32O6
Exact Mass: 368.2199
Source ID: CNP0418500.1
  • CAS Registry: 67910-12-7
  • KEGG: C05964
  • LipidMAPS: LMFA03030004
  • BioCYC:
24,25-Dihydrolanosterol

Formula: C30H52O
Exact Mass: 428.4018
Source ID: CNP0169560.1
  • CAS Registry: 79-62-9
  • KEGG: C05109
  • LipidMAPS: LMST01010087
  • BioCYC: CPD-8606
5-Amino-2-oxopentanoic acid

Formula: C5H9NO3
Exact Mass: 131.0582
Source ID: CNP0082812.0
  • CAS Registry: 2000-59-1
  • KEGG: C01110
  • LipidMAPS: LMFA01060169
  • BioCYC: 5-AMINO-2-OXOPENTANOATE
1-methylhistidine

Formula: C7H11N3O2
Exact Mass: 169.0851
Source ID: CNP0314068.1
  • CAS Registry: 332-80-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Phenyllactic acid

Formula: C9H10O3
Exact Mass: 166.063
Source ID: CNP0213490.1
  • CAS Registry: 828-01-3
  • KEGG: C01479
  • LipidMAPS:
  • BioCYC: CPD-7999
Alanine, 3-selenyl-

Formula: C3H7NO2Se
Exact Mass: 168.9642
Source ID: CNP0105616.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N6-Acetyl-L-lysine

Formula: C8H16N2O3
Exact Mass: 188.1161
Source ID: CNP0161259.1
  • CAS Registry: 692-04-6
  • KEGG: C02727
  • LipidMAPS:
  • BioCYC: CPD-567
1-Methyl-2-n-hexylbenzene

Formula: C13H20
Exact Mass: 176.1565
Source ID: CNP0102963.0
  • CAS Registry: 1595-10-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-beta-D-Galactosyl-sn-glycerol

Formula: C9H18O8
Exact Mass: 254.1002
Source ID: CNP0192217.3
  • CAS Registry: 16232-91-0
  • KEGG: C05401
  • LipidMAPS:
  • BioCYC: 3-B-D-GALACTOSYL-SN-GLYCEROL
1,1'-Oxybisoctane

Formula: C16H34O
Exact Mass: 242.261
Source ID: CNP0215186.0
  • CAS Registry: 629-82-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Aflatoxin B1

Formula: C17H12O6
Exact Mass: 312.0634
Source ID: CNP0296840.2
  • CAS Registry: 1162-65-8
  • KEGG: C06800
  • LipidMAPS: LMPK10000006
  • BioCYC:
Taurolithocholate

Formula: C26H45NO5S
Exact Mass: 483.3018
Source ID: CNP0409667.2
  • CAS Registry: 516-90-5
  • KEGG: C02592
  • LipidMAPS: LMST05040003
  • BioCYC:
Cholesteryl oleate

Formula: C45H78O2
Exact Mass: 650.6001
Source ID: CNP0359224.1
  • CAS Registry: 303-43-5
  • KEGG: C14641
  • LipidMAPS: LMST01020003
  • BioCYC: CPD-15951
2-[Ethyl(2-hydroxyethyl)amino]ethanol

Formula: C6H15NO2
Exact Mass: 133.1103
Source ID: CNP0368162.0
  • CAS Registry: 139-87-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Methylpropane-1,2-diol

Formula: C4H10O2
Exact Mass: 90.0681
Source ID: CNP0307478.0
  • CAS Registry: 558-43-0
  • KEGG: C21290
  • LipidMAPS:
  • BioCYC: CPD-19013
2-Hydroxy-3-methylbutyric acid

Formula: C5H10O3
Exact Mass: 118.063
Source ID: CNP0267024.2
  • CAS Registry: 4026-18-0
  • KEGG:
  • LipidMAPS: LMFA01050390
  • BioCYC:
6-Deoxy-D-galactose

Formula: C6H12O5
Exact Mass: 164.0685
Source ID: CNP0226197.8
  • CAS Registry: 3615-37-0
  • KEGG: C01018
  • LipidMAPS:
  • BioCYC: D-FUCOSE
1-Phenanthrol

Formula: C14H10O
Exact Mass: 194.0732
Source ID: CNP0172609.0
  • CAS Registry: 2433-56-9
  • KEGG: C11432
  • LipidMAPS:
  • BioCYC:
Thiocyanic acid

Formula: CHNS
Exact Mass: 58.983
Source ID: CNP0590020.0
  • CAS Registry: 463-56-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Glycolaldehyde

Formula: C2H4O2
Exact Mass: 60.0211
Source ID: CNP0600524.0
  • CAS Registry: 141-46-8
  • KEGG: C00266
  • LipidMAPS:
  • BioCYC: GLYCOLALDEHYDE
P1,P3-Bis(5'-adenosyl) triphosphate

Formula: C20H27N10O16P3
Exact Mass: 756.0819
Source ID: CNP0083548.1
  • CAS Registry: 5959-90-0
  • KEGG: C06197
  • LipidMAPS:
  • BioCYC:
N-Acetyl-L-alanine

Formula: C5H9NO3
Exact Mass: 131.0582
Source ID: CNP0136136.1
  • CAS Registry: 97-69-8
  • KEGG: C02847
  • LipidMAPS:
  • BioCYC:
Androstanediol

Formula: C19H32O2
Exact Mass: 292.2402
Source ID: CNP0200572.3
  • CAS Registry: 25126-76-5
  • KEGG: C07632
  • LipidMAPS: LMST02020052
  • BioCYC:
25-Hydroxycholesterol

Formula: C27H46O2
Exact Mass: 402.3498
Source ID: CNP0266481.1
  • CAS Registry: 2140-46-7
  • KEGG: C15519
  • LipidMAPS: LMST01010018
  • BioCYC: CPD-7285
3,3'-Diiodo-L-thyronine

Formula: C15H13I2NO4
Exact Mass: 524.8934
Source ID: CNP0152091.2
  • CAS Registry: 70-40-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Propyl butyrate

Formula: C7H14O2
Exact Mass: 130.0994
Source ID: CNP0083884.0
  • CAS Registry: 105-66-8
  • KEGG:
  • LipidMAPS: LMFA07010417
  • BioCYC:
5-Aminolevulinate

Formula: C5H9NO3
Exact Mass: 131.0582
Source ID: CNP0153451.0
  • CAS Registry: 106-60-5
  • KEGG: C00430
  • LipidMAPS: LMFA01100055
  • BioCYC: 5-AMINO-LEVULINATE
ADP

Formula: C10H15N5O10P2
Exact Mass: 427.0294
Source ID: CNP0404212.1
  • CAS Registry: 58-64-0
  • KEGG: C00008
  • LipidMAPS:
  • BioCYC:
2-(Dimethylamino)acetonitrile

Formula: C4H8N2
Exact Mass: 84.0687
Source ID: CNP0084986.0
  • CAS Registry: 926-64-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methoxybenzenepropanoic acid

Formula: C10H12O3
Exact Mass: 180.0786
Source ID: CNP0181921.0
  • CAS Registry: 10516-71-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
gamma-Glutamylvaline

Formula: C10H18N2O5
Exact Mass: 246.1216
Source ID: CNP0274174.1
  • CAS Registry: 2746-34-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Methylbiphenyl

Formula: C13H12
Exact Mass: 168.0939
Source ID: CNP0412652.0
  • CAS Registry: 644-08-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
LPC 16:0

Formula: C24H50NO7P
Exact Mass: 495.3325
Source ID: CNP0530017.1
  • CAS Registry: 17364-16-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Nutriacholic acid

Formula: C24H38O4
Exact Mass: 390.277
Source ID: CNP0299246.4
  • CAS Registry: 4651-67-6
  • KEGG:
  • LipidMAPS: LMST04010150
  • BioCYC:
gamma-Glutamylisoleucine

Formula: C11H20N2O5
Exact Mass: 260.1372
Source ID: CNP0225305.1
  • CAS Registry: 23632-83-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Stearoylglycine

Formula: C20H39NO3
Exact Mass: 341.293
Source ID: CNP0111447.0
  • CAS Registry: 6333-54-6
  • KEGG:
  • LipidMAPS: LMFA08020077
  • BioCYC:
2-Methyl-2-phenyl-undecane

Formula: C14H22
Exact Mass: 190.1721
Source ID: CNP0084483.0
  • CAS Registry: 27854-40-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,6-Dimethyl-4-heptanone

Formula: C9H18O
Exact Mass: 142.1358
Source ID: CNP0084478.0
  • CAS Registry: 108-83-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Allantoate

Formula: C4H8N4O4
Exact Mass: 176.0546
Source ID: CNP0270535.0
  • CAS Registry: 99-16-1
  • KEGG: C00499
  • LipidMAPS:
  • BioCYC: ALLANTOATE
Triiodothyronine

Formula: C15H12I3NO4
Exact Mass: 650.7901
Source ID: CNP0159539.1
  • CAS Registry: 6893-02-3
  • KEGG: C02465
  • LipidMAPS:
  • BioCYC: CPD-10813
3-Methyl-3-phenylazetidine

Formula: C10H13N
Exact Mass: 147.1048
Source ID: CNP0381007.0
  • CAS Registry: 5961-33-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4,4-Dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol

Formula: C29H46O
Exact Mass: 410.3548
Source ID: CNP0350053.1
  • CAS Registry: 64284-64-6
  • KEGG: C11455
  • LipidMAPS: LMST01010149
  • BioCYC: 44-DIMETHYL-CHOLESTA-814-24-TRIENOL
Androsterone

Formula: C19H30O2
Exact Mass: 290.2246
Source ID: CNP0199434.3
  • CAS Registry: 53-41-8
  • KEGG: C00523
  • LipidMAPS: LMST02020001
  • BioCYC: ANDROSTERONE
11beta-Hydroxyprogesterone

Formula: C21H30O3
Exact Mass: 330.2195
Source ID: CNP0212026.1
  • CAS Registry: 600-57-7
  • KEGG: C05498
  • LipidMAPS: LMST02030168
  • BioCYC:
21-Hydroxypregnenolone

Formula: C21H32O3
Exact Mass: 332.2351
Source ID: CNP0291601.1
  • CAS Registry: 1164-98-3
  • KEGG: C05485
  • LipidMAPS: LMST02030167
  • BioCYC:
17alpha-Hydroxypregnenolone

Formula: C21H32O3
Exact Mass: 332.2351
Source ID: CNP0310382.1
  • CAS Registry: 387-79-1
  • KEGG: C05138
  • LipidMAPS: LMST02030089
  • BioCYC: CPD66-23
N1,N12-Diacetylspermine

Formula: C14H30N4O2
Exact Mass: 286.2369
Source ID: CNP0209494.0
  • CAS Registry: 61345-83-3
  • KEGG: C03413
  • LipidMAPS:
  • BioCYC:
Mercaptopyruvic acid

Formula: C3H4O3S
Exact Mass: 119.9881
Source ID: CNP0172399.0
  • CAS Registry: 2464-23-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Nitrocatechol

Formula: C6H5NO4
Exact Mass: 155.0219
Source ID: CNP0593657.0
  • CAS Registry: 3316-09-4
  • KEGG: C02235
  • LipidMAPS:
  • BioCYC: CPD-158
1-Methylpyrrolinium

Formula: C5H10N
Exact Mass: 84.0813
Source ID: CNP0251573.0
  • CAS Registry: 16032-02-3
  • KEGG: C06178
  • LipidMAPS:
  • BioCYC:
3,4-Dihydroxyphenylacetaldehyde

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0123574.0
  • CAS Registry: 5707-55-1
  • KEGG: C04043
  • LipidMAPS:
  • BioCYC: 34-DIHYDROXYPHENYLACETALDEHYDE
N1-Methyl-2-pyridone-5-carboxamide

Formula: C7H8N2O2
Exact Mass: 152.0586
Source ID: CNP0249493.0
  • CAS Registry: 701-44-0
  • KEGG: C05842
  • LipidMAPS:
  • BioCYC:
7-Dehydrodesmosterol

Formula: C27H42O
Exact Mass: 382.3235
Source ID: CNP0117497.1
  • CAS Registry: 1715-86-2
  • KEGG: C05107
  • LipidMAPS: LMST01010121
  • BioCYC: CPD-8646
16alpha-Hydroxydehydroepiandrosterone

Formula: C19H28O3
Exact Mass: 304.2038
Source ID: CNP0188020.1
  • CAS Registry: 1232-73-1
  • KEGG: C05139
  • LipidMAPS: LMST02020064
  • BioCYC:
Pentachlorophenol

Formula: C6HCl5O
Exact Mass: 263.847
Source ID: CNP0169802.0
  • CAS Registry: 87-86-5
  • KEGG: C02575
  • LipidMAPS:
  • BioCYC: PENTACHLOROPHENOL
11beta-Hydroxyandrost-4-ene-3,17-dione

Formula: C19H26O3
Exact Mass: 302.1882
Source ID: CNP0165308.2
  • CAS Registry: 382-44-5
  • KEGG: C05284
  • LipidMAPS: LMST02020066
  • BioCYC:
14-Demethyllanosterol

Formula: C29H48O
Exact Mass: 412.3705
Source ID: CNP0312661.1
  • CAS Registry: 7448-02-4
  • KEGG: C05108
  • LipidMAPS: LMST01010176
  • BioCYC: 44-DIMETHYL-824-CHOLESTADIENOL
3-Hydroxy-L-kynurenine

Formula: C10H12N2O4
Exact Mass: 224.0797
Source ID: CNP0152494.1
  • CAS Registry: 606-14-4
  • KEGG: C03227
  • LipidMAPS:
  • BioCYC: 3-HYDROXY-L-KYNURENINE
(S)-2,3-Epoxysqualene

Formula: C30H50O
Exact Mass: 426.3861
Source ID: CNP0157616.1
  • CAS Registry: 54910-48-4
  • KEGG: C01054
  • LipidMAPS: LMPR0106010010
  • BioCYC: EPOXYSQUALENE
6-Keto-prostaglandin F1alpha

Formula: C20H34O6
Exact Mass: 370.2355
Source ID: CNP0165075.1
  • CAS Registry: 58962-34-8
  • KEGG: C05961
  • LipidMAPS: LMFA03010001
  • BioCYC:
Thromboxane B2

Formula: C20H34O6
Exact Mass: 370.2355
Source ID: CNP0234066.1
  • CAS Registry: 54397-85-2
  • KEGG: C05963
  • LipidMAPS: LMFA03030002
  • BioCYC:
Zymosterol

Formula: C27H44O
Exact Mass: 384.3392
Source ID: CNP0226907.1
  • CAS Registry: 128-33-6
  • KEGG: C05437
  • LipidMAPS: LMST01010066
  • BioCYC: ZYMOSTEROL
5alpha-Pregnane-3,20-dione

Formula: C21H32O2
Exact Mass: 316.2402
Source ID: CNP0201363.3
  • CAS Registry: 566-65-4
  • KEGG: C03681
  • LipidMAPS: LMST02030170
  • BioCYC: CPD-293
Calcium cation

Formula: Ca
Exact Mass: 39.9626
Source ID: CNP0578859.0
  • CAS Registry: 14127-61-8
  • KEGG: C00076
  • LipidMAPS:
  • BioCYC:
N-Acetyl-L-leucine

Formula: C8H15NO3
Exact Mass: 173.1052
Source ID: CNP0335270.1
  • CAS Registry: 1188-21-2
  • KEGG: C02710
  • LipidMAPS:
  • BioCYC: CPD-433
Hypochlorous acid

Formula: HClO
Exact Mass: 51.9716
Source ID: CNP0592985.0
  • CAS Registry: 7790-92-3
  • KEGG: C19697
  • LipidMAPS:
  • BioCYC: CPD-12799
Androstanediol

Formula: C19H32O2
Exact Mass: 292.2402
Source ID: CNP0200572.4
  • CAS Registry: 25126-76-5
  • KEGG: C07632
  • LipidMAPS: LMST02020052
  • BioCYC:
Prostaglandin C2

Formula: C20H30O4
Exact Mass: 334.2144
Source ID: CNP0304836.1
  • CAS Registry: 49825-91-4
  • KEGG: C05955
  • LipidMAPS: LMFA03010133
  • BioCYC:
1,1-Dimethoxy-2-phenylethane

Formula: C10H14O2
Exact Mass: 166.0994
Source ID: CNP0084836.0
  • CAS Registry: 101-48-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Phenylheptane

Formula: C13H20
Exact Mass: 176.1565
Source ID: CNP0084843.0
  • CAS Registry: 1078-71-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
bis(Benzyloxy)methane

Formula: C15H16O2
Exact Mass: 228.115
Source ID: CNP0124291.0
  • CAS Registry: 2749-70-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cholesterol sulfate

Formula: C27H46O4S
Exact Mass: 466.3117
Source ID: CNP0230675.1
  • CAS Registry: 1256-86-6
  • KEGG: C18043
  • LipidMAPS: LMST05020016
  • BioCYC:
Cholesteryl linoleate

Formula: C45H76O2
Exact Mass: 648.5845
Source ID: CNP0350990.1
  • CAS Registry: 604-33-1
  • KEGG: C15441
  • LipidMAPS: LMST01020008
  • BioCYC: CPD-21815
23(S),25-dihydroxy-24-oxovitamin D3

Formula: C27H42O4
Exact Mass: 430.3083
Source ID: CNP0266765.1
  • CAS Registry: 76338-50-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4-Dimethyl-2-pentene

Formula: C7H14
Exact Mass: 98.1095
Source ID: CNP0084966.0
  • CAS Registry: 625-65-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Glycolithocholate

Formula: C26H43NO4
Exact Mass: 433.3192
Source ID: CNP0176062.1
  • CAS Registry: 474-74-8
  • KEGG: C15557
  • LipidMAPS: LMST05030009
  • BioCYC:
3-Dehydrocarnitine

Formula: C7H13NO3
Exact Mass: 159.0895
Source ID: CNP0235581.0
  • CAS Registry: 10457-99-5
  • KEGG: C02636
  • LipidMAPS:
  • BioCYC: 3-DE-H-CARNITINE
Taurolithocholate sulfate

Formula: C26H45NO8S2
Exact Mass: 563.2586
Source ID: CNP0079828.1
  • CAS Registry: 15324-65-9
  • KEGG: C03642
  • LipidMAPS: LMST05020003
  • BioCYC:
LPC 18:2

Formula: C26H50NO7P
Exact Mass: 519.3325
Source ID: CNP0552745.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
DG 36:2

Formula: C39H72O5
Exact Mass: 620.5379
Source ID: CNP0199267.2
  • CAS Registry: 24529-88-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(R)-Propane-1,2-diol

Formula: C3H8O2
Exact Mass: 76.0524
Source ID: CNP0522839.2
  • CAS Registry: 4254-14-2
  • KEGG: C02912
  • LipidMAPS:
  • BioCYC: CPD-8891
3,4-Hexanedione

Formula: C6H10O2
Exact Mass: 114.0681
Source ID: CNP0249046.0
  • CAS Registry: 4437-51-8
  • KEGG:
  • LipidMAPS: LMFA12000016
  • BioCYC: CPD-9078
Calcitetrol

Formula: C27H44O4
Exact Mass: 432.3239
Source ID: CNP0082820.1
  • CAS Registry: 56142-94-0
  • KEGG: C18231
  • LipidMAPS: LMST03020686
  • BioCYC: CPD-10577
3-Methyl-2-cyclohexen-1-one

Formula: C7H10O
Exact Mass: 110.0732
Source ID: CNP0209762.0
  • CAS Registry: 1193-18-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-Pyrroline

Formula: C4H7N
Exact Mass: 69.0578
Source ID: CNP0581055.0
  • CAS Registry: 5724-81-2
  • KEGG: C15668
  • LipidMAPS:
  • BioCYC:
Dibenzo[a,l]pyrene

Formula: C24H14
Exact Mass: 302.1095
Source ID: CNP0082843.0
  • CAS Registry: 191-30-0
  • KEGG: C19174
  • LipidMAPS:
  • BioCYC:
2-Methyl-3-hexanone

Formula: C7H14O
Exact Mass: 114.1045
Source ID: CNP0310980.0
  • CAS Registry: 7379-12-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cer(d18:1/22:0)

Formula: C40H79NO3
Exact Mass: 621.606
Source ID: CNP0154976.1
  • CAS Registry: 27888-44-4
  • KEGG: C00195
  • LipidMAPS: LMSP02010008
  • BioCYC:
Glycoursodeoxycholic acid

Formula: C26H43NO5
Exact Mass: 449.3141
Source ID: CNP0567109.3
  • CAS Registry: 64480-66-6
  • KEGG:
  • LipidMAPS: LMST05030016
  • BioCYC:
LPC 15:0

Formula: C23H48NO7P
Exact Mass: 481.3168
Source ID: CNP0506587.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Amyl salicylate

Formula: C12H16O3
Exact Mass: 208.1099
Source ID: CNP0241972.0
  • CAS Registry: 2050-08-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-exo-hydroxy-1,4-cineole

Formula: C10H18O2
Exact Mass: 170.1307
Source ID: CNP0184060.1
  • CAS Registry: 87172-89-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Methyl-1-cyclopenten-1-yl)-ethanone

Formula: C8H12O
Exact Mass: 124.0888
Source ID: CNP0084970.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
7alpha-Hydroxycholest-4-en-3-one

Formula: C27H44O2
Exact Mass: 400.3341
Source ID: CNP0111476.1
  • CAS Registry: 3862-25-7
  • KEGG: C05455
  • LipidMAPS: LMST04030123
  • BioCYC: CPD-1087
N1-Methyl-4-pyridone-5-carboxamide

Formula: C7H8N2O2
Exact Mass: 152.0586
Source ID: CNP0212515.0
  • CAS Registry: 769-49-3
  • KEGG: C05843
  • LipidMAPS:
  • BioCYC:
3-Chlorotyrosine

Formula: C9H10ClNO3
Exact Mass: 215.0349
Source ID: CNP0342895.1
  • CAS Registry: 7423-93-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5(S)-HETE

Formula: C20H32O3
Exact Mass: 320.2351
Source ID: CNP0115304.1
  • CAS Registry: 70608-72-9
  • KEGG: C04805
  • LipidMAPS: LMFA03060084
  • BioCYC:
11(R)-HETE

Formula: C20H32O3
Exact Mass: 320.2351
Source ID: CNP0240331.2
  • CAS Registry: 73347-43-0
  • KEGG: C14780
  • LipidMAPS: LMFA03060028
  • BioCYC:
N-Formylglycine

Formula: C3H5NO3
Exact Mass: 103.0269
Source ID: CNP0082901.0
  • CAS Registry: 2491-15-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-pyrroline-2-carboxylic acid zwitterion

Formula: C5H7NO2
Exact Mass: 113.0477
Source ID: CNP0021263.0
  • CAS Registry: 2139-03-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Aldehydo-N-acetyl-D-glucosamine

Formula: C8H15NO6
Exact Mass: 221.0899
Source ID: CNP0520251.1
  • CAS Registry: 7512-17-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(3-Methyl-2-butenyl)-benzene

Formula: C11H14
Exact Mass: 146.1095
Source ID: CNP0096741.0
  • CAS Registry: 937-31-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Glycylglycine

Formula: C4H8N2O3
Exact Mass: 132.0535
Source ID: CNP0355149.0
  • CAS Registry: 556-50-3
  • KEGG: C02037
  • LipidMAPS:
  • BioCYC: GLYCYLGLYCINE
Tetrachloroethene

Formula: C2Cl4
Exact Mass: 163.8754
Source ID: CNP0108674.0
  • CAS Registry: 127-18-4
  • KEGG: C06789
  • LipidMAPS:
  • BioCYC: TETRACHLOROETHENE
DG(18:0/18:0/0:0)

Formula: C39H76O5
Exact Mass: 624.5692
Source ID: CNP0413240.1
  • CAS Registry: 10567-21-2
  • KEGG:
  • LipidMAPS: LMGL02010037
  • BioCYC:
Chloroform

Formula: CHCl3
Exact Mass: 117.9144
Source ID: CNP0479643.0
  • CAS Registry: 67-66-3
  • KEGG: C13827
  • LipidMAPS:
  • BioCYC: CPD-843
Terephthalate

Formula: C8H6O4
Exact Mass: 166.0266
Source ID: CNP0327537.0
  • CAS Registry: 100-21-0
  • KEGG: C06337
  • LipidMAPS:
  • BioCYC: TEREPHTHALATE
NMF

Formula: C2H5NO
Exact Mass: 59.0371
Source ID: CNP0565671.0
  • CAS Registry: 123-39-7
  • KEGG: C11489
  • LipidMAPS:
  • BioCYC:
1-Methyladenine

Formula: C6H7N5
Exact Mass: 149.0701
Source ID: CNP0232137.0
  • CAS Registry: 5142-22-3
  • KEGG: C02216
  • LipidMAPS:
  • BioCYC: 1-METHYLADENINE
2-Hydroxyethanesulfonate

Formula: C2H6O4S
Exact Mass: 125.9987
Source ID: CNP0267265.0
  • CAS Registry: 107-36-8
  • KEGG: C05123
  • LipidMAPS:
  • BioCYC: CPD-3745
o-Toluate

Formula: C8H8O2
Exact Mass: 136.0524
Source ID: CNP0280538.0
  • CAS Registry: 118-90-1
  • KEGG: C07215
  • LipidMAPS:
  • BioCYC:
3-Methyladenine

Formula: C6H7N5
Exact Mass: 149.0701
Source ID: CNP0153376.0
  • CAS Registry: 5142-23-4
  • KEGG: C00913
  • LipidMAPS:
  • BioCYC: 3-Methyl-Adenines
4,8-Dihydroxyquinoline

Formula: C9H7NO2
Exact Mass: 161.0477
Source ID: CNP0083510.0
  • CAS Registry: 14959-84-3
  • KEGG: C05637
  • LipidMAPS:
  • BioCYC:
N6-Methyl-L-lysine

Formula: C7H16N2O2
Exact Mass: 160.1212
Source ID: CNP0107109.1
  • CAS Registry: 1188-07-4
  • KEGG: C02728
  • LipidMAPS:
  • BioCYC:
Cacodylate

Formula: C2H7AsO2
Exact Mass: 137.9662
Source ID: CNP0492406.0
  • CAS Registry: 75-60-5
  • KEGG: C07308
  • LipidMAPS:
  • BioCYC: CPD-24362
Carbon tetrachloride

Formula: CCl4
Exact Mass: 151.8754
Source ID: CNP0532519.0
  • CAS Registry: 56-23-5
  • KEGG: C07561
  • LipidMAPS:
  • BioCYC: CPD-842
Aspartame

Formula: C14H18N2O5
Exact Mass: 294.1216
Source ID: CNP0285417.1
  • CAS Registry: 22839-47-0
  • KEGG: C11045
  • LipidMAPS:
  • BioCYC:
Tranexamic acid

Formula: C8H15NO2
Exact Mass: 157.1103
Source ID: CNP0204071.1
  • CAS Registry: 1197-18-8
  • KEGG: C12535
  • LipidMAPS:
  • BioCYC:
Acetamide

Formula: C2H5NO
Exact Mass: 59.0371
Source ID: CNP0570171.0
  • CAS Registry: 60-35-5
  • KEGG: C06244
  • LipidMAPS:
  • BioCYC: ACETAMIDE
alpha-Cryptoxanthin

Formula: C40H56O
Exact Mass: 552.4331
Source ID: CNP0127927.2
  • CAS Registry: 24480-38-4
  • KEGG: C15981
  • LipidMAPS: LMPR01070897
  • BioCYC: CPD-7421
Anhydrolutein I

Formula: C40H54O
Exact Mass: 550.4174
Source ID: CNP0230983.2
  • CAS Registry: 92760-20-8
  • KEGG:
  • LipidMAPS: LMPR01070964
  • BioCYC:
(1S,2S,3R)-2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E)-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,17,19,23-undecaenyl]-3-(2-hydroxypropan-2-yl)-1-methylcyclopentan-1-ol

Formula: C40H58O2
Exact Mass: 570.4437
Source ID: CNP0169920.3
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N5-Ethyl-L-glutamine

Formula: C7H14N2O3
Exact Mass: 174.1004
Source ID: CNP0109625.1
  • CAS Registry: 3081-61-6
  • KEGG: C01047
  • LipidMAPS:
  • BioCYC: CPD-9384
L-Histidinol

Formula: C6H11N3O
Exact Mass: 141.0902
Source ID: CNP0199265.1
  • CAS Registry: 4836-52-6
  • KEGG: C00860
  • LipidMAPS:
  • BioCYC: HISTIDINOL
10-Hydroxyyohimbine

Formula: C21H26N2O4
Exact Mass: 370.1892
Source ID: CNP0127409.3
  • CAS Registry: 41928-02-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
11-Hydroxyyohimbine

Formula: C21H26N2O4
Exact Mass: 370.1892
Source ID: CNP0128372.2
  • CAS Registry: 140405-13-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Progesterone

Formula: C21H30O2
Exact Mass: 314.2246
Source ID: CNP0364236.4
  • CAS Registry: 57-83-0
  • KEGG: C00410
  • LipidMAPS: LMST02030159
  • BioCYC: PROGESTERONE
3-Methylsalicylate

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0134592.0
  • CAS Registry: 45848-87-1
  • KEGG: C14088
  • LipidMAPS:
  • BioCYC:
Furan

Formula: C4H4O
Exact Mass: 68.0262
Source ID: CNP0601420.0
  • CAS Registry: 110-00-9
  • KEGG: C14275
  • LipidMAPS:
  • BioCYC: CPD-15491
ubiquinol-8

Formula: C49H76O4
Exact Mass: 728.5743
Source ID: CNP0410026.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-9956
5-Hydroxypentanoate

Formula: C5H10O3
Exact Mass: 118.063
Source ID: CNP0601188.0
  • CAS Registry: 13392-69-3
  • KEGG: C02804
  • LipidMAPS: LMFA01050010
  • BioCYC:
Nonanoylcarnitine

Formula: C16H31NO4
Exact Mass: 301.2253
Source ID: CNP0602352.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMFA07070082
  • BioCYC:
Copper

Formula: Cu
Exact Mass: 62.9296
Source ID: CNP0605585.0
  • CAS Registry: 7440-50-8
  • KEGG: C00070
  • LipidMAPS:
  • BioCYC: CU+2
2-(Methylthio)ethanol

Formula: C3H8OS
Exact Mass: 92.0296
Source ID: CNP0574269.0
  • CAS Registry: 5271-38-5
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-7677
Thiazole

Formula: C3H3NS
Exact Mass: 84.9986
Source ID: CNP0495876.0
  • CAS Registry: 288-47-1
  • KEGG: C02740
  • LipidMAPS:
  • BioCYC:
PC 36:2

Formula: C44H84NO8P
Exact Mass: 785.5934
Source ID: CNP0582738.2
  • CAS Registry: 4235-95-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cerium

Formula: Ce
Exact Mass: 139.9054
Source ID: CNP0602584.0
  • CAS Registry: 7440-45-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Deoxypyridinoline

Formula: C18H28N4O7
Exact Mass: 412.1958
Source ID: CNP0585988.0
  • CAS Registry: 83462-55-9
  • KEGG: C90318
  • LipidMAPS:
  • BioCYC:
PC 38:4

Formula: C46H84NO8P
Exact Mass: 809.5934
Source ID: CNP0554596.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,2 Diaminopropane

Formula: C3H10N2
Exact Mass: 74.0844
Source ID: CNP0579261.0
  • CAS Registry: 78-90-0
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-12574
Cesium

Formula: Cs
Exact Mass: 132.9054
Source ID: CNP0513307.0
  • CAS Registry: 7440-46-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Imidazole

Formula: C3H4N2
Exact Mass: 68.0374
Source ID: CNP0593616.0
  • CAS Registry: 288-32-4
  • KEGG: C01589
  • LipidMAPS:
  • BioCYC: IMIDAZOLE-RING
Tetrahydrofuran

Formula: C4H8O
Exact Mass: 72.0575
Source ID: CNP0507941.0
  • CAS Registry: 109-99-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cadmium

Formula: Cd
Exact Mass: 113.9034
Source ID: CNP0491772.0
  • CAS Registry: 7440-43-9
  • KEGG: C01413
  • LipidMAPS:
  • BioCYC:
trans-Hexadec-2-enoyl carnitine

Formula: C23H43NO4
Exact Mass: 397.3192
Source ID: CNP0515399.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS: LMFA07070109
  • BioCYC:
CDP-choline

Formula: C14H26N4O11P2
Exact Mass: 488.1073
Source ID: CNP0563777.2
  • CAS Registry: 987-78-0
  • KEGG: C00307
  • LipidMAPS:
  • BioCYC:


Formula: C21H21NO4
Exact Mass: 351.1471
Source ID: CNP0581567.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Acetonitrile

Formula: C2H3N
Exact Mass: 41.0265
Source ID: CNP0510997.0
  • CAS Registry: 75-05-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C2H6NO
Exact Mass: 60.0449
Source ID: CNP0586934.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methylglutarylcarnitine

Formula: C13H23NO6
Exact Mass: 289.1525
Source ID: CNP0592241.0
  • CAS Registry: 102673-95-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Hydroxyisourate

Formula: C5H4N4O4
Exact Mass: 184.0233
Source ID: CNP0085562.0
  • CAS Registry: 151359-24-9
  • KEGG: C11821
  • LipidMAPS:
  • BioCYC:
2-(Formamido)-N1-(5'-phosphoribosyl)acetamidine

Formula: C8H16N3O8P
Exact Mass: 313.0675
Source ID: CNP0083578.0
  • CAS Registry: 6157-85-3
  • KEGG: C04640
  • LipidMAPS:
  • BioCYC: 5-PHOSPHORIBOSYL-N-FORMYLGLYCINEAMIDINE
Canavaninosuccinate

Formula: C9H16N4O7
Exact Mass: 292.1019
Source ID: CNP0303145.0
  • CAS Registry: 56073-32-6
  • KEGG:
  • LipidMAPS:
  • BioCYC: CANAVANINOSUCCINATE
4-Hydroxyacid

Formula: C4H8O3
Exact Mass: 104.0473
Source ID: CNP0236331.0
  • CAS Registry: 591-81-1
  • KEGG: C01991
  • LipidMAPS: LMFA01050006
  • BioCYC:
Methylglutaric acid

Formula: C6H10O4
Exact Mass: 146.0579
Source ID: CNP0316583.0
  • CAS Registry: 626-51-7
  • KEGG:
  • LipidMAPS: LMFA01170117
  • BioCYC:
2,3-Pentanedione

Formula: C5H8O2
Exact Mass: 100.0524
Source ID: CNP0311036.0
  • CAS Registry: 600-14-6
  • KEGG:
  • LipidMAPS:
  • BioCYC: 23-PENTANEDIONE
2-Amino-2-methylpropanoate

Formula: C4H9NO2
Exact Mass: 103.0633
Source ID: CNP0299823.0
  • CAS Registry: 62-57-7
  • KEGG: C03665
  • LipidMAPS: LMFA01100053
  • BioCYC: CPD-17880
scyllo-Inositol

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0254016.8
  • CAS Registry: 488-59-5
  • KEGG: C06153
  • LipidMAPS:
  • BioCYC: CPD-8050
N,N-Dimethylformamide

Formula: C3H7NO
Exact Mass: 73.0528
Source ID: CNP0566193.0
  • CAS Registry: 68-12-2
  • KEGG: C03134
  • LipidMAPS:
  • BioCYC: CPD-581
Formamide

Formula: CH3NO
Exact Mass: 45.0215
Source ID: CNP0569834.0
  • CAS Registry: 75-12-7
  • KEGG: C00488
  • LipidMAPS:
  • BioCYC: FORMAMIDE
Malonaldehyde

Formula: C3H4O2
Exact Mass: 72.0211
Source ID: CNP0495847.0
  • CAS Registry: 542-78-9
  • KEGG: C19440
  • LipidMAPS:
  • BioCYC: CPD-21542
S-Methyl thioacetate

Formula: C3H6OS
Exact Mass: 90.0139
Source ID: CNP0491622.0
  • CAS Registry: 1534-08-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Carbon disulfide

Formula: CS2
Exact Mass: 75.9441
Source ID: CNP0482880.0
  • CAS Registry: 75-15-0
  • KEGG: C19033
  • LipidMAPS:
  • BioCYC: CPD-844
Glycine, N-[3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]-

Formula: C12H13NO5
Exact Mass: 251.0794
Source ID: CNP0441233.0
  • CAS Registry: 1220-05-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
15-Keto-prostaglandin F2alpha

Formula: C20H32O5
Exact Mass: 352.225
Source ID: CNP0223850.1
  • CAS Registry: 35850-13-6
  • KEGG: C05960
  • LipidMAPS: LMFA03010026
  • BioCYC:
1,3,7-Trimethyluric acid

Formula: C8H10N4O3
Exact Mass: 210.0753
Source ID: CNP0586994.0
  • CAS Registry: 5415-44-1
  • KEGG: C16361
  • LipidMAPS:
  • BioCYC: CPD-12480
4-Methylthiazole

Formula: C4H5NS
Exact Mass: 99.0143
Source ID: CNP0121199.0
  • CAS Registry: 693-95-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1,3-Dimethyluric acid

Formula: C7H8N4O3
Exact Mass: 196.0596
Source ID: CNP0306552.0
  • CAS Registry: 944-73-0
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-14118
2-Phenoxyethanol

Formula: C8H10O2
Exact Mass: 138.0681
Source ID: CNP0397013.0
  • CAS Registry: 122-99-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Diethanolamine

Formula: C4H11NO2
Exact Mass: 105.079
Source ID: CNP0247543.0
  • CAS Registry: 111-42-2
  • KEGG: C06772
  • LipidMAPS:
  • BioCYC:
7beta-Hydroxycholesterol

Formula: C27H46O2
Exact Mass: 402.3498
Source ID: CNP0147119.5
  • CAS Registry: 566-27-8
  • KEGG:
  • LipidMAPS: LMST01010047
  • BioCYC:
alpha-Hydroxyisobutyric acid

Formula: C4H8O3
Exact Mass: 104.0473
Source ID: CNP0230065.0
  • CAS Registry: 594-61-6
  • KEGG:
  • LipidMAPS: LMFA01050417
  • BioCYC:
2-Oxopentanoic acid

Formula: C5H8O3
Exact Mass: 116.0473
Source ID: CNP0186110.0
  • CAS Registry: 1821-02-9
  • KEGG: C06255
  • LipidMAPS: LMFA01060004
  • BioCYC:
Isovalerylglycine

Formula: C7H13NO3
Exact Mass: 159.0895
Source ID: CNP0207580.0
  • CAS Registry: 16284-60-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tiglylglycine

Formula: C7H11NO3
Exact Mass: 157.0739
Source ID: CNP0415761.0
  • CAS Registry: 35842-45-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Ethylmalonic acid

Formula: C5H8O4
Exact Mass: 132.0423
Source ID: CNP0415777.0
  • CAS Registry: 601-75-2
  • KEGG:
  • LipidMAPS: LMFA01170105
  • BioCYC:
3-Nitro-L-tyrosine

Formula: C9H10N2O5
Exact Mass: 226.059
Source ID: CNP0187770.2
  • CAS Registry: 3604-79-3
  • KEGG: C22981
  • LipidMAPS:
  • BioCYC:
Hydrochlorothiazide

Formula: C7H8ClN3O4S2
Exact Mass: 296.9645
Source ID: CNP0212821.0
  • CAS Registry: 58-93-5
  • KEGG: C07041
  • LipidMAPS:
  • BioCYC:
3-Diaminopropionic acid

Formula: C3H8N2O2
Exact Mass: 104.0586
Source ID: CNP0403048.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Imidazole-4-acetaldehyde

Formula: C5H6N2O
Exact Mass: 110.048
Source ID: CNP0573000.0
  • CAS Registry: 645-14-7
  • KEGG: C05130
  • LipidMAPS:
  • BioCYC: IMIDAZOLE_ACETALDEHYDE
Leucylphenylalanine

Formula: C15H22N2O3
Exact Mass: 278.163
Source ID: CNP0118564.1
  • CAS Registry: 3063-05-6
  • KEGG: C11221
  • LipidMAPS:
  • BioCYC:
Allopregnanolone

Formula: C21H34O2
Exact Mass: 318.2559
Source ID: CNP0198649.6
  • CAS Registry: 516-54-1
  • KEGG: C13712
  • LipidMAPS: LMST02030130
  • BioCYC: 3-BETA-HYDROXY-5-ALPHA-PREGNANE-20-ONE
Phenyllactate

Formula: C9H10O3
Exact Mass: 166.063
Source ID: CNP0213490.2
  • CAS Registry: 7326-19-4
  • KEGG: C05607
  • LipidMAPS:
  • BioCYC:
L-Homocitrulline

Formula: C7H15N3O3
Exact Mass: 189.1113
Source ID: CNP0047127.1
  • CAS Registry: 1190-49-4
  • KEGG: C02427
  • LipidMAPS:
  • BioCYC: CPD-161
6-Hydroxydopamine

Formula: C8H11NO3
Exact Mass: 169.0739
Source ID: CNP0204441.0
  • CAS Registry: 1199-18-4
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-7666
S-Sulfo-L-cysteine

Formula: C3H7NO5S2
Exact Mass: 200.9766
Source ID: CNP0272393.1
  • CAS Registry: 1637-71-4
  • KEGG: C05824
  • LipidMAPS:
  • BioCYC:
N-Acetyltryptophan

Formula: C13H14N2O3
Exact Mass: 246.1004
Source ID: CNP0293251.2
  • CAS Registry: 1218-34-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Valproic acid

Formula: C8H16O2
Exact Mass: 144.115
Source ID: CNP0384704.0
  • CAS Registry: 99-66-1
  • KEGG: C07185
  • LipidMAPS: LMFA01020291
  • BioCYC:
Etiocholanediol

Formula: C19H32O2
Exact Mass: 292.2402
Source ID: CNP0200572.6
  • CAS Registry: 1851-23-6
  • KEGG:
  • LipidMAPS: LMST02020077
  • BioCYC:
(5Z,13E)-11alpha-Hydroxy-9,15-dioxoprost-5,13-dienoate

Formula: C20H30O5
Exact Mass: 350.2093
Source ID: CNP0270184.1
  • CAS Registry: 26441-05-4
  • KEGG: C04707
  • LipidMAPS: LMFA03010030
  • BioCYC:
(R)-3-Amino-2-methylpropanoate

Formula: C4H9NO2
Exact Mass: 103.0633
Source ID: CNP0291505.2
  • CAS Registry: 2140-95-6
  • KEGG: C01205
  • LipidMAPS: LMFA01100049
  • BioCYC: CPD-471
2,6-Dimethylpyridine

Formula: C7H9N
Exact Mass: 107.0735
Source ID: CNP0246832.0
  • CAS Registry: 108-48-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pi-Methylimidazoleacetic acid

Formula: C6H8N2O2
Exact Mass: 140.0586
Source ID: CNP0052023.0
  • CAS Registry: 4200-48-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Loperamide

Formula: C29H33ClN2O2
Exact Mass: 476.223
Source ID: CNP0342959.0
  • CAS Registry: 53179-11-6
  • KEGG: C07080
  • LipidMAPS:
  • BioCYC:
Monoethyl phthalate

Formula: C10H10O4
Exact Mass: 194.0579
Source ID: CNP0017360.0
  • CAS Registry: 2306-33-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
17-HETE

Formula: C20H32O3
Exact Mass: 320.2351
Source ID: CNP0049536.0
  • CAS Registry: 128914-47-6
  • KEGG:
  • LipidMAPS: LMFA03060091
  • BioCYC:
6-Hydroxyhexanoic acid

Formula: C6H12O3
Exact Mass: 132.0786
Source ID: CNP0079830.0
  • CAS Registry: 1191-25-9
  • KEGG: C06103
  • LipidMAPS: LMFA01050015
  • BioCYC:
N-Methylnicotinamide

Formula: C7H8N2O
Exact Mass: 136.0637
Source ID: CNP0108098.0
  • CAS Registry: 114-33-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4-Dichlorophenol

Formula: C6H4Cl2O
Exact Mass: 161.9639
Source ID: CNP0401033.0
  • CAS Registry: 120-83-2
  • KEGG: C02625
  • LipidMAPS:
  • BioCYC: 24-DICHLOROPHENOL
Neuraminic acid

Formula: C9H17NO8
Exact Mass: 267.0954
Source ID: CNP0150729.1
  • CAS Registry: 114-04-5
  • KEGG: C06469
  • LipidMAPS:
  • BioCYC: CPD-10760
4,6-Diamino-5-formamidopyrimidine

Formula: C5H7N5O
Exact Mass: 153.0651
Source ID: CNP0343500.0
  • CAS Registry: 5122-36-1
  • KEGG: C06502
  • LipidMAPS:
  • BioCYC:
Propionylglycine

Formula: C5H9NO3
Exact Mass: 131.0582
Source ID: CNP0322949.0
  • CAS Registry: 21709-90-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Hydroxyisocaproic acid

Formula: C6H12O3
Exact Mass: 132.0786
Source ID: CNP0270190.2
  • CAS Registry: 13748-90-8
  • KEGG:
  • LipidMAPS: LMFA01050408
  • BioCYC:
Dehydrocorticosterone

Formula: C21H28O4
Exact Mass: 344.1987
Source ID: CNP0138042.2
  • CAS Registry: 72-23-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
20-Hydroxypregn-4-en-3-one

Formula: C21H32O2
Exact Mass: 316.2402
Source ID: CNP0323939.2
  • CAS Registry: 15114-79-1
  • KEGG: C03965
  • LipidMAPS: LMST02030152
  • BioCYC:
Imidazolone

Formula: C3H4N2O
Exact Mass: 84.0324
Source ID: CNP0321519.0
  • CAS Registry: 1968-28-1
  • KEGG: C06195
  • LipidMAPS:
  • BioCYC: CPD-60
S-Nitrosoglutathione

Formula: C10H16N4O7S
Exact Mass: 336.074
Source ID: CNP0079819.1
  • CAS Registry: 57564-91-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Thiodiacetic acid

Formula: C4H6O4S
Exact Mass: 149.9987
Source ID: CNP0310100.0
  • CAS Registry: 123-93-3
  • KEGG: C14872
  • LipidMAPS:
  • BioCYC:
Carnosine

Formula: C9H14N4O3
Exact Mass: 226.1066
Source ID: CNP0418201.1
  • CAS Registry: 305-84-0
  • KEGG: C00386
  • LipidMAPS:
  • BioCYC:
Hexanoylglycine

Formula: C8H15NO3
Exact Mass: 173.1052
Source ID: CNP0098252.0
  • CAS Registry: 24003-67-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isobutyrylglycine

Formula: C6H11NO3
Exact Mass: 145.0739
Source ID: CNP0079797.0
  • CAS Registry: 15926-18-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Methylcrotonylglycine

Formula: C7H11NO3
Exact Mass: 157.0739
Source ID: CNP0318208.0
  • CAS Registry: 33008-07-0
  • KEGG: C20828
  • LipidMAPS:
  • BioCYC:
Kyotorphin

Formula: C15H23N5O4
Exact Mass: 337.175
Source ID: CNP0517770.1
  • CAS Registry: 70904-56-2
  • KEGG: C02993
  • LipidMAPS:
  • BioCYC:
Acetaminophen glucuronide

Formula: C14H17NO8
Exact Mass: 327.0954
Source ID: CNP0165466.1
  • CAS Registry: 16110-10-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N4-(Acetyl-beta-D-glucosaminyl)asparagine

Formula: C12H21N3O8
Exact Mass: 335.1329
Source ID: CNP0176186.1
  • CAS Registry: 2776-93-4
  • KEGG: C04540
  • LipidMAPS:
  • BioCYC:
7-Hydroxyoctanoic acid

Formula: C8H16O3
Exact Mass: 160.1099
Source ID: CNP0406993.0
  • CAS Registry: 17173-14-7
  • KEGG:
  • LipidMAPS: LMFA01050229
  • BioCYC:
Imidazolelactic acid

Formula: C6H8N2O3
Exact Mass: 156.0535
Source ID: CNP0041361.0
  • CAS Registry: 876-19-7
  • KEGG: C05132
  • LipidMAPS:
  • BioCYC:
A,b-Dihydroxyisobutyric acid

Formula: C4H8O4
Exact Mass: 120.0423
Source ID: CNP0027858.0
  • CAS Registry: 21620-60-0
  • KEGG:
  • LipidMAPS: LMFA01050400
  • BioCYC:
Glycyltyrosine

Formula: C11H14N2O4
Exact Mass: 238.0954
Source ID: CNP0395180.1
  • CAS Registry: 658-79-7
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-20346
2-Methylhippuric acid

Formula: C10H11NO3
Exact Mass: 193.0739
Source ID: CNP0079825.0
  • CAS Registry: 42013-20-7
  • KEGG: C01586
  • LipidMAPS:
  • BioCYC:
Methyl isobutyrate

Formula: C5H10O2
Exact Mass: 102.0681
Source ID: CNP0354997.0
  • CAS Registry: 547-63-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-methyl-2,3-dihydrofuran

Formula: C5H8O
Exact Mass: 84.0575
Source ID: CNP0165220.0
  • CAS Registry: 1708-27-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Hydroxysuberic acid

Formula: C8H14O5
Exact Mass: 190.0841
Source ID: CNP0421145.0
  • CAS Registry: 73141-47-6
  • KEGG:
  • LipidMAPS: LMFA01170093
  • BioCYC:
3-Hydroxysebacic acid

Formula: C10H18O5
Exact Mass: 218.1154
Source ID: CNP0002388.0
  • CAS Registry: 446881-43-2
  • KEGG:
  • LipidMAPS: LMFA01170092
  • BioCYC:
16alpha-Hydroxypregnenolone

Formula: C21H32O3
Exact Mass: 332.2351
Source ID: CNP0292041.1
  • CAS Registry: 520-88-7
  • KEGG: C06390
  • LipidMAPS: LMST02030172
  • BioCYC:
Aldosterone

Formula: C21H28O5
Exact Mass: 360.1937
Source ID: CNP0202085.3
  • CAS Registry: 52-39-1
  • KEGG: C01780
  • LipidMAPS: LMST02030026
  • BioCYC: ALDOSTERONE
(S)-3-Hydroxyisobutyrate

Formula: C4H8O3
Exact Mass: 104.0473
Source ID: CNP0257203.1
  • CAS Registry: 26543-05-5
  • KEGG: C06001
  • LipidMAPS:
  • BioCYC:
ITP

Formula: C10H15N4O14P3
Exact Mass: 507.9798
Source ID: CNP0297720.1
  • CAS Registry: 132-06-9
  • KEGG: C00081
  • LipidMAPS:
  • BioCYC: ITP
2-Methylacetoacetic acid

Formula: C5H8O3
Exact Mass: 116.0473
Source ID: CNP0002342.0
  • CAS Registry: 76652-88-5
  • KEGG:
  • LipidMAPS: LMFA01060192
  • BioCYC:
1-Hydroxy-2-butanone

Formula: C4H8O2
Exact Mass: 88.0524
Source ID: CNP0165007.0
  • CAS Registry: 5077-67-8
  • KEGG: C75383
  • LipidMAPS:
  • BioCYC: CPD0-2414
Allopurinol

Formula: C5H4N4O
Exact Mass: 136.0385
Source ID: CNP0335791.0
  • CAS Registry: 315-30-0
  • KEGG: D00224
  • LipidMAPS:
  • BioCYC: CPD-9024
Bilirubin

Formula: C33H36N4O6
Exact Mass: 584.2635
Source ID: CNP0542148.0
  • CAS Registry: 635-65-4
  • KEGG: C00486
  • LipidMAPS:
  • BioCYC: BILIRUBIN
UDP-glucuronate

Formula: C15H22N2O18P2
Exact Mass: 580.0343
Source ID: CNP0605955.1
  • CAS Registry: 2616-64-0
  • KEGG: C00167
  • LipidMAPS:
  • BioCYC:
IMP

Formula: C10H13N4O8P
Exact Mass: 348.0471
Source ID: CNP0605860.1
  • CAS Registry: 131-99-7
  • KEGG: C00130
  • LipidMAPS:
  • BioCYC: IMP
Dihydrofolate

Formula: C19H21N7O6
Exact Mass: 443.1553
Source ID: CNP0600224.1
  • CAS Registry: 4033-27-6
  • KEGG: C00415
  • LipidMAPS:
  • BioCYC: THF
2-pyridin-3-yl-3,4-dihydro-2H-pyrrol-5-ol

Formula: C9H10N2O
Exact Mass: 162.0793
Source ID: CNP0597392.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2-icosa-8,11,14,17-tetraenoyloxy-3-tetracosoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate

Formula: C52H98NO7P
Exact Mass: 879.7081
Source ID: CNP0600822.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(1R,2S)-1-[(6R)-4-hydroxy-2-imino-5,6,7,8-tetrahydro-1H-pteridin-6-yl]propane-1,2-diol

Formula: C9H15N5O3
Exact Mass: 241.1175
Source ID: CNP0524125.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-imino-7-methyl-3H-purin-6-ol

Formula: C6H7N5O
Exact Mass: 165.0651
Source ID: CNP0572989.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Paracetamol sulfate

Formula: C8H9NO5S
Exact Mass: 231.0201
Source ID: CNP0138963.0
  • CAS Registry: 10066-90-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Urate

Formula: C5H4N4O3
Exact Mass: 168.0283
Source ID: CNP0533546.0
  • CAS Registry: 69-93-2
  • KEGG: C00366
  • LipidMAPS:
  • BioCYC: URATE
4-Hydroxyphenanthrene

Formula: C14H10O
Exact Mass: 194.0732
Source ID: CNP0042525.0
  • CAS Registry: 7651-86-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Leucyl-Isoleucine

Formula: C12H24N2O3
Exact Mass: 244.1787
Source ID: CNP0592580.1
  • CAS Registry: 36077-41-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Orotate

Formula: C5H4N2O4
Exact Mass: 156.0171
Source ID: CNP0569904.0
  • CAS Registry: 65-86-1
  • KEGG: C00295
  • LipidMAPS:
  • BioCYC: OROTATE
(1R,2S)-1-(4-hydroxy-2-imino-1H-pteridin-6-yl)propane-1,2-diol

Formula: C9H11N5O3
Exact Mass: 237.0862
Source ID: CNP0487305.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4,6-Dihydroxyquinoline

Formula: C9H7NO2
Exact Mass: 161.0477
Source ID: CNP0568965.0
  • CAS Registry: 3517-61-1
  • KEGG: C05639
  • LipidMAPS:
  • BioCYC:
2,5-Dichlorophenol

Formula: C6H4Cl2O
Exact Mass: 161.9639
Source ID: CNP0236901.0
  • CAS Registry: 583-78-8
  • KEGG: C06602
  • LipidMAPS:
  • BioCYC: 25-DICHLOROPHENOL
2-methylimino-3,9-dihydropurin-6-ol

Formula: C6H7N5O
Exact Mass: 165.0651
Source ID: CNP0536839.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Tuftsin

Formula: C21H40N8O6
Exact Mass: 500.3071
Source ID: CNP0505216.0
  • CAS Registry: 112592-90-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Mirex

Formula: C10Cl12
Exact Mass: 539.6262
Source ID: CNP0230511.0
  • CAS Registry: 2385-85-5
  • KEGG: C14184
  • LipidMAPS:
  • BioCYC:
2-imino-7-methyl-3H-purine-6,8-diol

Formula: C6H7N5O2
Exact Mass: 181.06
Source ID: CNP0542688.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
N-Acetyl-beta-alanine

Formula: C5H9NO3
Exact Mass: 131.0582
Source ID: CNP0454986.0
  • CAS Registry: 3025-95-4
  • KEGG: C01073
  • LipidMAPS:
  • BioCYC: CPD-580
Cobalt

Formula: Co
Exact Mass: 58.9332
Source ID: CNP0490633.0
  • CAS Registry: 7440-48-4
  • KEGG: C19171
  • LipidMAPS:
  • BioCYC: CO+1
2-[[(2S)-5-hydroxy-3,4-dihydro-2H-pyrrole-2-carbonyl]amino]acetic acid

Formula: C7H10N2O4
Exact Mass: 186.0641
Source ID: CNP0546826.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,8-dihydroxy-1,7-dimethylpurin-6-one

Formula: C7H8N4O3
Exact Mass: 196.0596
Source ID: CNP0489527.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2S)-2-[[4-[[(6S)-4-hydroxy-2-imino-5,6,7,8-tetrahydro-1H-pteridin-6-yl]methylamino]benzoyl]amino]pentanedioic acid

Formula: C19H23N7O6
Exact Mass: 445.171
Source ID: CNP0564846.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-hydroxy-4-iminopyrimidin-1-yl)oxolan-2-yl]methyl phosphono hydrogen phosphate

Formula: C9H15N3O11P2
Exact Mass: 403.0182
Source ID: CNP0496033.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(2-hydroxy-4-iminopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate

Formula: C9H16N3O13P3
Exact Mass: 466.9896
Source ID: CNP0485978.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-hydroxypurin-9-yl)oxolan-2-yl]methyl phosphono hydrogen phosphate

Formula: C10H14N4O11P2
Exact Mass: 428.0134
Source ID: CNP0548858.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
CMP

Formula: C9H14N3O8P
Exact Mass: 323.0518
Source ID: CNP0558557.1
  • CAS Registry: 63-37-6
  • KEGG: C00055
  • LipidMAPS:
  • BioCYC: CMP
UDP

Formula: C9H14N2O12P2
Exact Mass: 404.0022
Source ID: CNP0547495.1
  • CAS Registry: 58-98-0
  • KEGG: C00015
  • LipidMAPS:
  • BioCYC:
Lindane

Formula: C6H6Cl6
Exact Mass: 287.8601
Source ID: CNP0194683.1
  • CAS Registry: 58-89-9
  • KEGG: C07075
  • LipidMAPS:
  • BioCYC: CPD-21372
N-Acetylaspartylglutamate

Formula: C11H16N2O8
Exact Mass: 304.0907
Source ID: CNP0371023.1
  • CAS Registry: 3106-85-2
  • KEGG: C12270
  • LipidMAPS:
  • BioCYC:
[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] [[(2R,3S,4R,5R)-3,4-dihydroxy-5-(4-hydroxy-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate

Formula: C17H27N3O17P2
Exact Mass: 607.0816
Source ID: CNP0578986.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Glycylproline

Formula: C7H12N2O3
Exact Mass: 172.0848
Source ID: CNP0295271.1
  • CAS Registry: 704-15-4
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-10814
3-[(2Z)-2-[[3-(2-carboxyethyl)-5-[[(2S,3R,4R)-3-ethyl-5-hydroxy-4-methyl-3,4-dihydro-2H-pyrrol-2-yl]methyl]-4-methyl-1H-pyrrol-2-yl]methylidene]-5-[[(2S,3R,4R)-4-ethyl-5-hydroxy-3-methyl-3,4-dihydro-2H-pyrrol-2-yl]methyl]-4-methylpyrrol-3-yl]propanoic acid

Formula: C33H46N4O6
Exact Mass: 594.3417
Source ID: CNP0079803.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[[(2S,3R,4S,5S)-3,4-dihydroxy-5-(4-hydroxy-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] [(3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate

Formula: C15H24N2O17P2
Exact Mass: 566.055
Source ID: CNP0602545.4
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-(2-Methylpropyl)-cyclohexene

Formula: C10H18
Exact Mass: 138.1408
Source ID: CNP0511862.0
  • CAS Registry: 4104-56-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2R,14S,15S)-14-(2-hydroxyacetyl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-5-one

Formula: C21H30O3
Exact Mass: 330.2195
Source ID: CNP0239493.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: ClH2Tl
Exact Mass: 241.9589
Source ID: CNP0576412.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
epsilon-Caprolactam

Formula: C6H11NO
Exact Mass: 113.0841
Source ID: CNP0523769.0
  • CAS Registry: 105-60-2
  • KEGG: C06593
  • LipidMAPS:
  • BioCYC: CPD-883
Chromium

Formula: Cr
Exact Mass: 51.9405
Source ID: CNP0567681.0
  • CAS Registry: 7440-47-3
  • KEGG: C06268
  • LipidMAPS:
  • BioCYC: CR+3
8(S)-HETE

Formula: C20H32O3
Exact Mass: 320.2351
Source ID: CNP0177392.4
  • CAS Registry: 98462-03-4
  • KEGG: C14776
  • LipidMAPS: LMFA03060086
  • BioCYC:
Androstanediol

Formula: C19H32O2
Exact Mass: 292.2402
Source ID: CNP0200572.14
  • CAS Registry: 25126-76-5
  • KEGG: C07632
  • LipidMAPS: LMST02020052
  • BioCYC:
Sulfolithocholic acid

Formula: C24H40O6S
Exact Mass: 456.2545
Source ID: CNP0362249.2
  • CAS Registry: 34669-57-3
  • KEGG:
  • LipidMAPS: LMST05020015
  • BioCYC:
Symmetric dimethylarginine

Formula: C8H18N4O2
Exact Mass: 202.143
Source ID: CNP0262089.2
  • CAS Registry: 30344-00-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
SM(d18:1/18:1(11Z))

Formula: C41H81N2O6P
Exact Mass: 728.5832
Source ID: CNP0490290.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-diol

Formula: C9H12N2O6
Exact Mass: 244.0695
Source ID: CNP0603983.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Creatinine

Formula: C4H7N3O
Exact Mass: 113.0589
Source ID: CNP0479644.0
  • CAS Registry: 60-27-5
  • KEGG: C00791
  • LipidMAPS:
  • BioCYC: CREATININE
1-Methylxanthine

Formula: C6H6N4O2
Exact Mass: 166.0491
Source ID: CNP0481491.0
  • CAS Registry: 6136-37-4
  • KEGG: C16358
  • LipidMAPS:
  • BioCYC: CPD-9025
NPD9605

Formula: C9H13N5O4
Exact Mass: 255.0967
Source ID: CNP0597283.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Androsterone

Formula: C19H30O2
Exact Mass: 290.2246
Source ID: CNP0199434.7
  • CAS Registry: 53-41-8
  • KEGG: C00523
  • LipidMAPS: LMST02020001
  • BioCYC: ANDROSTERONE
[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl [[(2~{R},3~{S},4~{R},5~{R})-3,4-dihydroxy-5-[3-(hydroxycarbonimidoyl)pyridin-1-ium-1-yl]tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphate

Formula: C21H27N7O14P2
Exact Mass: 663.1091
Source ID: CNP0515713.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2~{S})-1-[(4~{R},5~{Z},7~{S},8~{Z},10~{S},11~{Z},13~{S},14~{Z},16~{S},17~{Z},19~{R})-19-amino-7-(2-amino-2-oxo-ethyl)-10-(3-amino-3-oxo-propyl)-6,9,12,15,18-pentahydroxy-16-[(4-hydroxyphenyl)methyl]-13-[(1~{S})-1-methylpropyl]-1,2-dithia-5,8,11,14,17-pentazacycloicosa-5,8,11,14,17-pentaene-4-carbonyl]-~{N}-[(1~{S})-1-[(2-amino-2-oxo-ethyl)carbamoyl]-3-methyl-butyl]pyrrolidine-2-carboxamide

Formula: C43H66N12O12S2
Exact Mass: 1006.4364
Source ID: CNP0508352.3
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PD050698

Formula: C20H34O5
Exact Mass: 354.2406
Source ID: CNP0481036.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4,5-diphenyl-1H-triazole

Formula: C14H11N3
Exact Mass: 221.0953
Source ID: CNP0500182.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pyrazinoic acid

Formula: C5H4N2O2
Exact Mass: 124.0273
Source ID: CNP0274739.0
  • CAS Registry: 98-97-5
  • KEGG: C19915
  • LipidMAPS:
  • BioCYC: PYRAZINOIC-ACID


Formula: C27H42O3
Exact Mass: 414.3134
Source ID: CNP0606745.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
TG 48:1

Formula: C51H96O6
Exact Mass: 804.7207
Source ID: CNP0316402.3
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C20H30O8S
Exact Mass: 430.1661
Source ID: CNP0308571.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Hydroxyphenanthrene

Formula: C14H10O
Exact Mass: 194.0732
Source ID: CNP0047567.0
  • CAS Registry: 605-87-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-imino-3H-purine-6,8-diol

Formula: C10H13N5O6
Exact Mass: 299.0866
Source ID: CNP0595899.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Neu5NAcalpha2->6lactose

Formula: C23H39NO19
Exact Mass: 633.2116
Source ID: CNP0548906.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Ethoxyethanol

Formula: C4H10O2
Exact Mass: 90.0681
Source ID: CNP0319988.0
  • CAS Registry: 110-80-5
  • KEGG: C14687
  • LipidMAPS:
  • BioCYC:
Mesalazine

Formula: C7H7NO3
Exact Mass: 153.0426
Source ID: CNP0079833.0
  • CAS Registry: 89-57-6
  • KEGG: D00377
  • LipidMAPS:
  • BioCYC: CPD-12711
(2S)-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-hydroxy-3,4-dihydro-2H-pyrrole-2-carboxamide

Formula: C16H22N6O4
Exact Mass: 362.1702
Source ID: CNP0554074.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cys-tyr-phe-gln-asn-cys-pro-arg

Formula: C44H61N13O12S2
Exact Mass: 1027.4004
Source ID: CNP0487530.0
  • CAS Registry: 37552-33-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Sialyllactose

Formula: C23H39NO19
Exact Mass: 633.2116
Source ID: CNP0221895.1
  • CAS Registry: 64839-33-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-amino-3-hydroxy-6-(trimethylazaniumyl)hexanoate

Formula: C9H20N2O3
Exact Mass: 204.1474
Source ID: CNP0541228.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2~{S})-2-amino-5-[(~{N},~{N}-dimethylcarbamimidoyl)amino]pentanoic acid

Formula: C8H18N4O2
Exact Mass: 202.143
Source ID: CNP0258830.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]-6-hydroxy-2-oxopyrimidine-4-carboxylic acid

Formula: C10H13N2O11P
Exact Mass: 368.0257
Source ID: CNP0486427.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,8-dihydroxy-1-methyl-9H-purin-6-one

Formula: C6H6N4O3
Exact Mass: 182.044
Source ID: CNP0586927.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-hydroxy-4-iminopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

Formula: C9H16N3O14P3
Exact Mass: 482.9845
Source ID: CNP0497557.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Taurocyamine

Formula: C3H9N3O3S
Exact Mass: 167.0365
Source ID: CNP0518855.0
  • CAS Registry: 543-18-0
  • KEGG: C01959
  • LipidMAPS:
  • BioCYC: TAUROCYAMINE
Desmosine

Formula: C24H40N5O8
Exact Mass: 526.2877
Source ID: CNP0597994.1
  • CAS Registry: 11003-57-9
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-20415
Glycyl-Isoleucine

Formula: C8H16N2O3
Exact Mass: 188.1161
Source ID: CNP0564336.1
  • CAS Registry: 19461-38-2
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-20343
[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] [[(2R,3S,4R,5R)-3,4-dihydroxy-5-(4-hydroxy-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate

Formula: C17H27N3O17P2
Exact Mass: 607.0816
Source ID: CNP0578986.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Estriol 3-glucuronide

Formula: C24H32O9
Exact Mass: 464.2046
Source ID: CNP0079822.2
  • CAS Registry: 2479-91-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-[2-[[3-(2-carboxyethyl)-5-[(3-ethenyl-5-hydroxy-4-methylpyrrol-2-ylidene)methyl]-4-methyl-1H-pyrrol-2-yl]methylidene]-5-[(4-ethenyl-5-hydroxy-3-methylpyrrol-2-ylidene)methyl]-4-methylpyrrol-3-yl]propanoic acid

Formula: C33H34N4O6
Exact Mass: 582.2478
Source ID: CNP0533524.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-imino-3,9-dihydropurine-6,8-diol

Formula: C5H5N5O2
Exact Mass: 167.0443
Source ID: CNP0490477.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
9,11,15-Trihydroxy-prosta-5,13-dien-1-oic acid

Formula: C20H34O5
Exact Mass: 354.2406
Source ID: CNP0248684.12
  • CAS Registry: 27415-26-5
  • KEGG: C13809
  • LipidMAPS: LMFA03110001
  • BioCYC:
(2R,3R,4S,5R)-2-(2-hydroxy-4-imino-5-methylpyrimidin-1-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Formula: C10H15N3O5
Exact Mass: 257.1012
Source ID: CNP0553223.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Kojibiose

Formula: C12H22O11
Exact Mass: 342.1162
Source ID: CNP0212730.2
  • CAS Registry: 2140-29-6
  • KEGG: C19632
  • LipidMAPS:
  • BioCYC:
carbonimidodithioic acid

Formula: CH3NS2
Exact Mass: 92.9707
Source ID: CNP0574797.0
  • CAS Registry: 594-07-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isocyanic acid

Formula: CHNO
Exact Mass: 43.0058
Source ID: CNP0504564.0
  • CAS Registry: 75-13-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
20-COOH-Leukotriene B4

Formula: C20H30O6
Exact Mass: 366.2042
Source ID: CNP0230002.2
  • CAS Registry: 80434-82-8
  • KEGG: C05950
  • LipidMAPS: LMFA03020016
  • BioCYC:
6,8-dihydroxy-3,7-dimethylpurin-2-one

Formula: C7H8N4O3
Exact Mass: 196.0596
Source ID: CNP0234959.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(S)-Goniothalamin

Formula: C13H12O2
Exact Mass: 200.0837
Source ID: CNP0179728.4
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
1-[(4aR,6R,7R,7aS)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-4-iminopyrimidin-2-ol

Formula: C9H12N3O7P
Exact Mass: 305.0413
Source ID: CNP0509088.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pimelylcarnitine

Formula: C14H25NO6
Exact Mass: 303.1682
Source ID: CNP0510621.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4S)-2,3,4-trihydroxy-5-(4-hydroxy-7,8-dimethyl-2-oxobenzo[g]pteridin-10-yl)pentyl] hydrogen phosphate

Formula: C27H33N9O15P2
Exact Mass: 785.1571
Source ID: CNP0515307.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(6-hydroxy-2-imino-3H-purin-9-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate

Formula: C10H16N5O13P3
Exact Mass: 506.9957
Source ID: CNP0601930.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-imino-3H-purine-6,8-diol

Formula: C10H13N5O5
Exact Mass: 283.0917
Source ID: CNP0536732.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[5-(4-amino-1H-imidazol-3-ium-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate

Formula: C8H14N3O7P
Exact Mass: 295.0569
Source ID: CNP0512677.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Betazole

Formula: C5H9N3
Exact Mass: 111.0796
Source ID: CNP0506107.0
  • CAS Registry: 105-20-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Isoleucyl-Leucine

Formula: C12H24N2O3
Exact Mass: 244.1787
Source ID: CNP0528780.1
  • CAS Registry: 26462-22-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
sodium 6-carboxy-2-hydroxy-pyrimidin-4-olate

Formula: C5H3N2NaO4
Exact Mass: 177.9991
Source ID: CNP0579704.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C21H28O5
Exact Mass: 360.1937
Source ID: CNP0233309.4
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(4-hydroxy-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

Formula: C9H15N2O15P3
Exact Mass: 483.9685
Source ID: CNP0543695.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[(2R,3S,4S)-2,3,4-trihydroxy-5-(4-hydroxy-7,8-dimethyl-2-oxobenzo[g]pteridin-10-yl)pentyl] dihydrogen phosphate

Formula: C17H21N4O9P
Exact Mass: 456.1046
Source ID: CNP0551430.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
PS(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C46H78NO10P
Exact Mass: 835.5363
Source ID: CNP0161038.2
  • CAS Registry: 137173-98-9
  • KEGG: C02737
  • LipidMAPS: LMGP03010040
  • BioCYC:
5-Guanidino-2-hydroxypentanoic acid

Formula: C6H13N3O3
Exact Mass: 175.0957
Source ID: CNP0568828.0
  • CAS Registry: 462-64-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-hydroxy-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-one

Formula: C5H4N4O2
Exact Mass: 152.0334
Source ID: CNP0503440.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-hydroxy-2-oxopyrimidine-4-carboxylic acid

Formula: C10H12N2O8
Exact Mass: 288.0594
Source ID: CNP0596384.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Hydroxycotinine

Formula: C10H12N2O2
Exact Mass: 192.0899
Source ID: CNP0281121.2
  • CAS Registry: 34834-67-8
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-2750
D-Norvaline

Formula: C5H11NO2
Exact Mass: 117.079
Source ID: CNP0198245.2
  • CAS Registry: 2013-12-9
  • KEGG: C01799
  • LipidMAPS:
  • BioCYC:
[hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(4-hydroxy-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate

Formula: C9H15N2O14P3
Exact Mass: 467.9736
Source ID: CNP0596185.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Hexachlorobenzene

Formula: C6Cl6
Exact Mass: 281.8131
Source ID: CNP0369084.0
  • CAS Registry: 118-74-1
  • KEGG: C11042
  • LipidMAPS:
  • BioCYC: CPD-24462
Homocarnosine

Formula: C10H16N4O3
Exact Mass: 240.1222
Source ID: CNP0533649.1
  • CAS Registry: 3650-73-5
  • KEGG: C00884
  • LipidMAPS:
  • BioCYC: CPD-12185


Formula: C23H35NO9S2
Exact Mass: 533.1753
Source ID: CNP0344944.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C6H7O6
Exact Mass: 175.0243
Source ID: CNP0575291.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Phosphocreatine

Formula: C4H10N3O5P
Exact Mass: 211.0358
Source ID: CNP0537820.0
  • CAS Registry: 67-07-2
  • KEGG: C02305
  • LipidMAPS:
  • BioCYC: CREATINE-P
Testosterone

Formula: C19H28O2
Exact Mass: 288.2089
Source ID: CNP0201721.5
  • CAS Registry: 58-22-0
  • KEGG: C00535
  • LipidMAPS: LMST02020002
  • BioCYC: TESTOSTERONE
7-(2-hydroxy-5-oct-2-enylidenecyclopent-3-en-1-yl)hept-5-enoic acid

Formula: C20H30O3
Exact Mass: 318.2195
Source ID: CNP0515069.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
MG(20:4(5Z,8Z,11Z,14Z)/0:0/0:0)

Formula: C23H38O4
Exact Mass: 378.277
Source ID: CNP0142758.2
  • CAS Registry: 124511-15-5
  • KEGG:
  • LipidMAPS: LMGL01010032
  • BioCYC:
NCGC00093634-01

Formula: C19H30O2
Exact Mass: 290.2246
Source ID: CNP0199434.8
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Neurotensin

Formula: C78H121N21O20
Exact Mass: 1671.9096
Source ID: CNP0522295.0
  • CAS Registry: 39379-15-2
  • KEGG: C01836
  • LipidMAPS:
  • BioCYC:
LPC 6:0

Formula: C14H30NO7P
Exact Mass: 355.176
Source ID: CNP0563735.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2R,3S,4R,5R)-2-(hydroxymethyl)-5-(4-hydroxypyrazolo[3,4-d]pyrimidin-1-yl)oxolane-3,4-diol

Formula: C10H12N4O5
Exact Mass: 268.0808
Source ID: CNP0539676.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2S)-5-amino-2-[[(2S)-5-hydroxy-3,4-dihydro-2H-pyrrole-2-carbonyl]amino]-5-oxopentanoic acid

Formula: C10H15N3O5
Exact Mass: 257.1012
Source ID: CNP0524897.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4,5-dihydropyrimidine-2,6-diol

Formula: C4H6N2O2
Exact Mass: 114.0429
Source ID: CNP0488616.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Oxohexanoic acid

Formula: C6H10O3
Exact Mass: 130.063
Source ID: CNP0456571.0
  • CAS Registry: 3128-06-1
  • KEGG: C02129
  • LipidMAPS: LMFA01060010
  • BioCYC:


Formula: C20H30O7S
Exact Mass: 414.1712
Source ID: CNP0306918.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC: