Angelica sinensis (species) - 数据之源，洞见之始

Angelica sinensis

ncbi_taxid: 165353 - Angelica sinensis(species); all_childs:

taxonomy name: Angelica sinensis (species)
ancestor: Angelica (genus)

Child Taxonomy

taxonomy name	rank	note

Enzyme Proteins

protein id	name	ec_number	function

Metabolites

LCMS Annotations

Literature Annotations

Metabolite	Database Reference	Structure
D-Glucose Formula: C6H12O6 Exact Mass: 180.0634 Source ID: CNP0210547.4	CAS Registry: 50-99-7 KEGG: C00031 LipidMAPS: BioCYC: D-Glucose
Uracil Formula: C4H4N2O2 Exact Mass: 112.0273 Source ID: CNP0289236.0	CAS Registry: 66-22-8 KEGG: C00106 LipidMAPS: BioCYC: URACIL
Adenosine Formula: C10H13N5O4 Exact Mass: 267.0967 Source ID: CNP0216822.2	CAS Registry: 58-61-7 KEGG: C00212 LipidMAPS: BioCYC: ADENOSINE
Levistolide A Formula: C24H28O4 Exact Mass: 380.1987 Source ID: CNP0253547.1	CAS Registry: 89708-23-6 KEGG: LipidMAPS: BioCYC:
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
Ligustilide Formula: C12H14O2 Exact Mass: 190.0994 Source ID: CNP0257129.0	CAS Registry: 4431-01-0 KEGG: C16987 LipidMAPS: BioCYC:
Butylidenephthalide Formula: C12H12O2 Exact Mass: 188.0837 Source ID: CNP0279341.0	CAS Registry: 551-08-6 KEGG: C16924 LipidMAPS: BioCYC:
Myristicin Formula: C11H12O3 Exact Mass: 192.0786 Source ID: CNP0188030.0	CAS Registry: 607-91-0 KEGG: C10480 LipidMAPS: BioCYC:
Ferulate Formula: C10H10O4 Exact Mass: 194.0579 Source ID: CNP0304940.0	CAS Registry: 537-98-4 KEGG: C01494 LipidMAPS: BioCYC: FERULIC-ACID
Isoimperatorin Formula: C16H14O4 Exact Mass: 270.0892 Source ID: CNP0187563.0	CAS Registry: 482-45-1 KEGG: C16976 LipidMAPS: BioCYC:
Xanthotoxin Formula: C12H8O4 Exact Mass: 216.0423 Source ID: CNP0214931.0	CAS Registry: 298-81-7 KEGG: C01864 LipidMAPS: BioCYC: CPD-13042
beta-Caryophyllene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0212910.1	CAS Registry: 87-44-5 KEGG: C09629 LipidMAPS: LMPR0103120001 BioCYC: CPD-8230
Umbelliferone Formula: C9H6O3 Exact Mass: 162.0317 Source ID: CNP0291283.0	CAS Registry: 93-35-6 KEGG: C09315 LipidMAPS: BioCYC: CPD-8186
Bergapten Formula: C12H8O4 Exact Mass: 216.0423 Source ID: CNP0211069.0	CAS Registry: 484-20-8 KEGG: C01557 LipidMAPS: BioCYC: 5-METHOXYFURANOCOUMARIN
Scopoletin Formula: C10H8O4 Exact Mass: 192.0423 Source ID: CNP0184442.0	CAS Registry: 92-61-5 KEGG: C01752 LipidMAPS: BioCYC: SCOPOLETIN
Caffeate Formula: C9H8O4 Exact Mass: 180.0423 Source ID: CNP0186784.0	CAS Registry: 331-39-5 KEGG: C01481 LipidMAPS: BioCYC: CPD-8098
Falcarindiol Formula: C17H24O2 Exact Mass: 260.1776 Source ID: CNP0229318.1	CAS Registry: 55297-87-5 KEGG: C08449 LipidMAPS: LMFA05000658 BioCYC:
2-isopropyl-7H-furo[3,2-g]chromen-7-one Formula: C14H12O3 Exact Mass: 228.0786 Source ID: CNP0261778.0	CAS Registry: 1215-38-9 KEGG: LipidMAPS: BioCYC:
Esculetin Formula: C9H6O4 Exact Mass: 178.0266 Source ID: CNP0386988.0	CAS Registry: 305-01-1 KEGG: C09263 LipidMAPS: BioCYC: CPD-8097
Formula: C22H33NO Exact Mass: 327.2562 Source ID: CNP0279506.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
4-Hydroxybenzoate Formula: C7H6O3 Exact Mass: 138.0317 Source ID: CNP0253685.0	CAS Registry: 99-96-7 KEGG: C00156 LipidMAPS: BioCYC:
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
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
Sulcatone Formula: C8H14O Exact Mass: 126.1045 Source ID: CNP0330890.0	CAS Registry: 110-93-0 KEGG: C07287 LipidMAPS: LMFA12000039 BioCYC: CPD-7969
Linolenelaidic acid Formula: C18H30O2 Exact Mass: 278.2246 Source ID: CNP0149780.0	CAS Registry: 28290-79-1 KEGG: LipidMAPS: BioCYC:
Methyleugenol Formula: C11H14O2 Exact Mass: 178.0994 Source ID: CNP0137352.0	CAS Registry: 93-15-2 KEGG: C10454 LipidMAPS: BioCYC: CPD-6482
Hexyl acetate Formula: C8H16O2 Exact Mass: 144.115 Source ID: CNP0292917.0	CAS Registry: 142-92-7 KEGG: LipidMAPS: LMFA07010184 BioCYC: CPD-19627
Phenylacetaldehyde Formula: C8H8O Exact Mass: 120.0575 Source ID: CNP0175320.0	CAS Registry: 122-78-1 KEGG: C00601 LipidMAPS: BioCYC: PHENYLACETALDEHYDE
Furfuryl alcohol Formula: C5H6O2 Exact Mass: 98.0368 Source ID: CNP0152361.0	CAS Registry: 98-00-0 KEGG: C20441 LipidMAPS: BioCYC: CPD-14102
(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
farnesyl acetone Formula: C18H30O Exact Mass: 262.2297 Source ID: CNP0243354.0	CAS Registry: 1117-52-8 KEGG: LipidMAPS: BioCYC: CPD-12898
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
beta-Farnesene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0242426.0	CAS Registry: 18794-84-8 KEGG: C09666 LipidMAPS: LMFA11000040 BioCYC: CPD-8239
Linoelaidic acid Formula: C18H32O2 Exact Mass: 280.2402 Source ID: CNP0194582.0	CAS Registry: 506-21-8 KEGG: LipidMAPS: LMFA01030123 BioCYC:
Fumarate Formula: C4H4O4 Exact Mass: 116.011 Source ID: CNP0289193.0	CAS Registry: 110-17-8 KEGG: C00122 LipidMAPS: BioCYC: FUM
N-cis-Feruloyltyramine Formula: C18H19NO4 Exact Mass: 313.1314 Source ID: CNP0278544.0	CAS Registry: 80510-09-4 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
alpha-Farnesene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0220187.0	CAS Registry: 502-61-4 KEGG: C09665 LipidMAPS: BioCYC: CPD-8764
2-Acetylpyrrole Formula: C6H7NO Exact Mass: 109.0528 Source ID: CNP0200282.0	CAS Registry: 1072-83-9 KEGG: LipidMAPS: BioCYC:
(+)-Sabinene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0146195.1	CAS Registry: 2009-00-9 KEGG: C20230 LipidMAPS: LMPR0102120036 BioCYC: CPD-14013
Verbenone Formula: C10H14O Exact Mass: 150.1045 Source ID: CNP0109275.1	CAS Registry: 18309-32-5 KEGG: C09913 LipidMAPS: BioCYC:
o-Cresol Formula: C7H8O Exact Mass: 108.0575 Source ID: CNP0242840.0	CAS Registry: 95-48-7 KEGG: C01542 LipidMAPS: BioCYC: CPD-109
5-Methyl-2-furaldehyde Formula: C6H6O2 Exact Mass: 110.0368 Source ID: CNP0142902.0	CAS Registry: 620-02-0 KEGG: C11115 LipidMAPS: BioCYC:
beta-Cadinene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0308562.1	CAS Registry: 523-47-7 KEGG: C09625 LipidMAPS: LMPR0103330003 BioCYC:
alpha-Elemol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0192070.1	CAS Registry: 639-99-6 KEGG: LipidMAPS: BioCYC:
Methyl linoleate Formula: C19H34O2 Exact Mass: 294.2559 Source ID: CNP0199763.0	CAS Registry: 112-63-0 KEGG: LipidMAPS: BioCYC:
Hexadecane Formula: C16H34 Exact Mass: 226.266 Source ID: CNP0250856.0	CAS Registry: 544-76-3 KEGG: C14499 LipidMAPS: LMFA11000577 BioCYC: CPD-8509
Caffeic acid ethyl ester Formula: C11H12O4 Exact Mass: 208.0736 Source ID: CNP0251886.0	CAS Registry: 102-37-4 KEGG: LipidMAPS: BioCYC:
beta-Eudesmol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0292043.1	CAS Registry: 473-15-4 KEGG: C09664 LipidMAPS: BioCYC: CPD-11432
(-)-Camphene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0256268.1	CAS Registry: 5794-04-7 KEGG: C06305 LipidMAPS: BioCYC: CPD-4921
Bornyl acetate Formula: C12H20O2 Exact Mass: 196.1463 Source ID: CNP0222907.1	CAS Registry: 20347-65-3 KEGG: C11338 LipidMAPS: LMPR0102120020 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
Safranal Formula: C10H14O Exact Mass: 150.1045 Source ID: CNP0229410.0	CAS Registry: 116-26-7 KEGG: C17062 LipidMAPS: BioCYC: CPD-8669
Octadec-9-enoic Acid Formula: C18H34O2 Exact Mass: 282.2559 Source ID: CNP0142072.0	CAS Registry: 2027-47-6 KEGG: LipidMAPS: BioCYC:
Ethyl acetate Formula: C4H8O2 Exact Mass: 88.0524 Source ID: CNP0322418.0	CAS Registry: 141-78-6 KEGG: C00849 LipidMAPS: BioCYC: ETHYLACETATE
Propanoate Formula: C3H6O2 Exact Mass: 74.0368 Source ID: CNP0572679.0	CAS Registry: 79-09-4 KEGG: C00163 LipidMAPS: LMFA01010003 BioCYC:
3-Methyl-2(3-methylbut-2-en-1-yl)furan Formula: C10H14O Exact Mass: 150.1045 Source ID: CNP0224893.0	CAS Registry: 15186-51-3 KEGG: LipidMAPS: BioCYC:
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
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:
2-Pentylfuran Formula: C9H14O Exact Mass: 138.1045 Source ID: CNP0210535.0	CAS Registry: 3777-69-3 KEGG: LipidMAPS: BioCYC:
p-Cymene Formula: C10H14 Exact Mass: 134.1095 Source ID: CNP0145577.0	CAS Registry: 99-87-6 KEGG: C06575 LipidMAPS: LMPR0102090014 BioCYC: CPD-1001
Seselin Formula: C14H12O3 Exact Mass: 228.0786 Source ID: CNP0388303.0	CAS Registry: 523-59-1 KEGG: C09312 LipidMAPS: BioCYC:
Phenol Formula: C6H6O Exact Mass: 94.0419 Source ID: CNP0155356.0	CAS Registry: 108-95-2 KEGG: C00146 LipidMAPS: BioCYC: PHENOL
4-Vinylguaiacol Formula: C9H10O2 Exact Mass: 150.0681 Source ID: CNP0357819.0	CAS Registry: 7786-61-0 KEGG: C17883 LipidMAPS: BioCYC: CPD-1072
Serotonin Formula: C10H12N2O Exact Mass: 176.095 Source ID: CNP0110235.0	CAS Registry: 50-67-9 KEGG: C00780 LipidMAPS: BioCYC: SEROTONIN
Angelicin Formula: C11H6O3 Exact Mass: 186.0317 Source ID: CNP0192500.0	CAS Registry: 523-50-2 KEGG: C09060 LipidMAPS: BioCYC: CPD-9815
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
Phenylacetic acid Formula: C8H8O2 Exact Mass: 136.0524 Source ID: CNP0311203.0	CAS Registry: 103-82-2 KEGG: C07086 LipidMAPS: BioCYC: PHENYLACETATE
Citrate Formula: C6H8O7 Exact Mass: 192.027 Source ID: CNP0149674.0	CAS Registry: 77-92-9 KEGG: C00158 LipidMAPS: BioCYC: CIT
1-Isopropyl-2-methylbenzene Formula: C10H14 Exact Mass: 134.1095 Source ID: CNP0093801.0	CAS Registry: 527-84-4 KEGG: LipidMAPS: BioCYC:
Nonacosane Formula: C29H60 Exact Mass: 408.4695 Source ID: CNP0139246.0	CAS Registry: 630-03-5 KEGG: C08384 LipidMAPS: LMFA11000005 BioCYC: CPD-7940
Butanal Formula: C4H8O Exact Mass: 72.0575 Source ID: CNP0518034.0	CAS Registry: 123-72-8 KEGG: C01412 LipidMAPS: BioCYC: BUTANAL
L-Valine Formula: C5H11NO2 Exact Mass: 117.079 Source ID: CNP0152507.1	CAS Registry: 72-18-4 KEGG: C00183 LipidMAPS: BioCYC: VAL
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
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:
Guaiol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0189004.1	CAS Registry: 489-86-1 KEGG: C09676 LipidMAPS: LMPR0103410007 BioCYC:
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
Indole Formula: C8H7N Exact Mass: 117.0578 Source ID: CNP0118430.0	CAS Registry: 120-72-9 KEGG: C00463 LipidMAPS: BioCYC: INDOLE
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
Sebacic acid Formula: C10H18O4 Exact Mass: 202.1205 Source ID: CNP0311812.0	CAS Registry: 111-20-6 KEGG: C08277 LipidMAPS: LMFA01170006 BioCYC: CPD-3623
Furfural Formula: C5H4O2 Exact Mass: 96.0211 Source ID: CNP0178160.0	CAS Registry: 98-01-1 KEGG: C14279 LipidMAPS: BioCYC: CPD0-2357
Succinate Formula: C4H6O4 Exact Mass: 118.0266 Source ID: CNP0332012.0	CAS Registry: 110-15-6 KEGG: C00042 LipidMAPS: LMFA01170043 BioCYC: SUC
Guaiacol Formula: C7H8O2 Exact Mass: 124.0524 Source ID: CNP0269885.0	CAS Registry: 90-05-1 KEGG: C15572 LipidMAPS: BioCYC: CPD-400
Psoralen Formula: C11H6O3 Exact Mass: 186.0317 Source ID: CNP0328096.0	CAS Registry: 66-97-7 KEGG: C09305 LipidMAPS: BioCYC: PHYTOALEXIN-CMPD
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
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
Calycosin Formula: C16H12O5 Exact Mass: 284.0685 Source ID: CNP0121394.0	CAS Registry: 20575-57-9 KEGG: C01562 LipidMAPS: LMPK12050056 BioCYC: CPD-9539
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
Nodakenin Formula: C20H24O9 Exact Mass: 408.142 Source ID: CNP0285316.1	CAS Registry: 495-31-8 KEGG: C09279 LipidMAPS: BioCYC:
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
Carvacrol Formula: C10H14O Exact Mass: 150.1045 Source ID: CNP0210919.0	CAS Registry: 499-75-2 KEGG: C09840 LipidMAPS: LMPR0102090017 BioCYC: CPD-23478
(6'S)-beta,epsilon-carotene Formula: C40H56 Exact Mass: 536.4382 Source ID: CNP0220836.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Isophorone Formula: C9H14O Exact Mass: 138.1045 Source ID: CNP0196251.0	CAS Registry: 78-59-1 KEGG: C14743 LipidMAPS: BioCYC:
bisabolene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0126761.0	CAS Registry: 495-62-5 KEGG: LipidMAPS: BioCYC:
Octadecanol Formula: C18H38O Exact Mass: 270.2922 Source ID: CNP0192475.0	CAS Registry: 112-92-5 KEGG: D01924 LipidMAPS: LMFA05000085 BioCYC: CPD-7873
Imperatorin Formula: C16H14O4 Exact Mass: 270.0892 Source ID: CNP0270767.0	CAS Registry: 482-44-0 KEGG: C09269 LipidMAPS: BioCYC: CPD-20603
Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0210398.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
(R)-2-methylbutyric acid Formula: C5H10O2 Exact Mass: 102.0681 Source ID: CNP0187792.1	CAS Registry: 32231-50-8 KEGG: 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
N-Butylbenzenesulfonamide Formula: C10H15NO2S Exact Mass: 213.0823 Source ID: CNP0249531.0	CAS Registry: 3622-84-2 KEGG: 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
Dictamnine Formula: C12H9NO2 Exact Mass: 199.0633 Source ID: CNP0159011.0	CAS Registry: 484-29-7 KEGG: C10660 LipidMAPS: BioCYC:
D-Valine Formula: C5H11NO2 Exact Mass: 117.079 Source ID: CNP0152507.2	CAS Registry: 640-68-6 KEGG: C06417 LipidMAPS: BioCYC: CPD-3642
D-Pipecolic acid Formula: C6H11NO2 Exact Mass: 129.079 Source ID: CNP0148927.1	CAS Registry: 1723-00-8 KEGG: LipidMAPS: BioCYC: CPD-11619
Coniferyl alcohol Formula: C10H12O3 Exact Mass: 180.0786 Source ID: CNP0239078.0	CAS Registry: 32811-40-8 KEGG: C00590 LipidMAPS: BioCYC: CONIFERYL-ALCOHOL
Dibutyl phthalate Formula: C16H22O4 Exact Mass: 278.1518 Source ID: CNP0105770.0	CAS Registry: 84-74-2 KEGG: C14214 LipidMAPS: BioCYC:
Maltol Formula: C6H6O3 Exact Mass: 126.0317 Source ID: CNP0287207.0	CAS Registry: 118-71-8 KEGG: C11918 LipidMAPS: BioCYC: CPD-15508
gamma-Butyrolactone Formula: C4H6O2 Exact Mass: 86.0368 Source ID: CNP0315299.0	CAS Registry: 96-48-0 KEGG: C01770 LipidMAPS: LMFA07040004 BioCYC:
2',4'-Dihydroxyacetophenone Formula: C8H8O3 Exact Mass: 152.0473 Source ID: CNP0230310.0	CAS Registry: 89-84-9 KEGG: C03663 LipidMAPS: BioCYC: CPD-242
Bicyclogermacrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0196946.1	CAS Registry: 24703-35-3 KEGG: C20175 LipidMAPS: LMPR0103100001 BioCYC: CPD-13870
Safrole Formula: C10H10O2 Exact Mass: 162.0681 Source ID: CNP0320423.0	CAS Registry: 94-59-7 KEGG: C10490 LipidMAPS: BioCYC: CPD-21978
Pentadecanoic acid Formula: C15H30O2 Exact Mass: 242.2246 Source ID: CNP0296248.0	CAS Registry: 1002-84-2 KEGG: C16537 LipidMAPS: LMFA01010015 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
Diosgenin Formula: C27H42O3 Exact Mass: 414.3134 Source ID: CNP0192744.3	CAS Registry: 512-04-9 KEGG: C08898 LipidMAPS: LMST01080037 BioCYC: CPD-15437
(Z)-13-Octadecenoic acid Formula: C18H34O2 Exact Mass: 282.2559 Source ID: CNP0290765.0	CAS Registry: 13126-39-1 KEGG: LipidMAPS: LMFA01030290 BioCYC:
Oleamide Formula: C18H35NO Exact Mass: 281.2719 Source ID: CNP0300480.0	CAS Registry: 301-02-0 KEGG: C19670 LipidMAPS: LMFA08010004 BioCYC: CPD6666-1
2-Methylisoindole-1,3-Dione Formula: C9H7NO2 Exact Mass: 161.0477 Source ID: CNP0399263.0	CAS Registry: 550-44-7 KEGG: LipidMAPS: BioCYC:
Ethyl 4-hydroxy-3-methoxycinnamate Formula: C12H14O4 Exact Mass: 222.0892 Source ID: CNP0259003.0	CAS Registry: 4046-02-0 KEGG: LipidMAPS: BioCYC: CPD-23483
Eucalyptin Formula: C19H18O5 Exact Mass: 326.1154 Source ID: CNP0277923.0	CAS Registry: 3122-88-1 KEGG: LipidMAPS: LMPK12111028 BioCYC:
Dimethyl phthalate Formula: C10H10O4 Exact Mass: 194.0579 Source ID: CNP0145942.0	CAS Registry: 131-11-3 KEGG: C11233 LipidMAPS: BioCYC:
Dimethyl Nonanedioate Formula: C11H20O4 Exact Mass: 216.1362 Source ID: CNP0189349.0	CAS Registry: 1732-10-1 KEGG: LipidMAPS: BioCYC:
Phyllanthin Formula: C24H34O6 Exact Mass: 418.2355 Source ID: CNP0249609.1	CAS Registry: 10351-88-9 KEGG: C10746 LipidMAPS: BioCYC:
dimethyl sebacate Formula: C12H22O4 Exact Mass: 230.1518 Source ID: CNP0302547.0	CAS Registry: 106-79-6 KEGG: LipidMAPS: BioCYC:
Tryptamine Formula: C10H12N2 Exact Mass: 160.1 Source ID: CNP0329876.0	CAS Registry: 61-54-1 KEGG: C00398 LipidMAPS: BioCYC: TRYPTAMINE
Marmesin Formula: C14H14O4 Exact Mass: 246.0892 Source ID: CNP0155202.1	CAS Registry: 13849-08-6 KEGG: C09276 LipidMAPS: BioCYC:
Methyl palmitate Formula: C17H34O2 Exact Mass: 270.2559 Source ID: CNP0274232.0	CAS Registry: 112-39-0 KEGG: C16995 LipidMAPS: LMFA07010470 BioCYC: Methylhexadecanoates
Quinate Formula: C7H12O6 Exact Mass: 192.0634 Source ID: CNP0205647.2	CAS Registry: 77-95-2 KEGG: C00296 LipidMAPS: BioCYC: QUINATE
2,5-Dimethylbenzaldehyde Formula: C9H10O Exact Mass: 134.0732 Source ID: CNP0076382.0	CAS Registry: 5779-94-2 KEGG: LipidMAPS: BioCYC:
Formula: C28H30O9 Exact Mass: 510.189 Source ID: CNP0248577.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C27H30O16 Exact Mass: 610.1534 Source ID: CNP0196290.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
SOLANIGROSIDE C Formula: C51H82O26 Exact Mass: 1110.5094 Source ID: CNP0213667.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C7H8O2 Exact Mass: 124.0524 Source ID: CNP0538068.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
.beta.-Barbatene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0115748.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Falcarinol Formula: C17H24O Exact Mass: 244.1827 Source ID: CNP0228485.1	CAS Registry: 21852-80-2 KEGG: C08450 LipidMAPS: LMFA05000689 BioCYC:
Angelicone Formula: C16H16O5 Exact Mass: 288.0998 Source ID: CNP0170996.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
cobaltous;3-[17-[3-[2-[[5-(5,6-dimethyl-3~{H}-benzimidazol-1-ium-1-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]oxy-hydroxy-phosphoryl]oxypropylimino]-3-hydroxy-propyl]-2,7,18-tris(2-hydroxy-2-imino-ethyl)-3-(3-hydroxy-3-imino-propyl)-13-(3-imino-3-oxido-propyl)-1,2,5,7,12,12,15,17-octamethyl-3,8,13,18,19,21-hexahydrocorrin-8-yl]propanimidate;cyanide Formula: C63H89CoN14O14P Exact Mass: 1355.5752 Source ID: CNP0535939.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Butyrophenone Formula: C10H12O Exact Mass: 148.0888 Source ID: CNP0079774.0	CAS Registry: 495-40-9 KEGG: LipidMAPS: BioCYC: CPD-23535
p-Mentha-1(7),2-dien-8-ol Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0076810.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
alpha-acoradiene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0222112.1	CAS Registry: 24048-44-0 KEGG: LipidMAPS: BioCYC: CPD-13268
Formula: C27H30O16 Exact Mass: 610.1534 Source ID: CNP0196290.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
Coniferyl ferulate Formula: C20H20O6 Exact Mass: 356.126 Source ID: CNP0191439.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
3',4'-Dimethylacetophenone Formula: C10H12O Exact Mass: 148.0888 Source ID: CNP0091143.0	CAS Registry: 3637-01-2 KEGG: LipidMAPS: BioCYC:
2,4,6-Trimethylbenzaldehyde Formula: C10H12O Exact Mass: 148.0888 Source ID: CNP0234902.0	CAS Registry: 487-68-3 KEGG: LipidMAPS: BioCYC:
Formula: C39H62O12 Exact Mass: 722.4241 Source ID: CNP0279057.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
alpha-Muurolene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0163726.2	CAS Registry: 10208-80-7 KEGG: C20272 LipidMAPS: BioCYC: CPD-8798
gamma-Sitosterol Formula: C29H50O Exact Mass: 414.3861 Source ID: CNP0236620.7	CAS Registry: 83-47-6 KEGG: C19654 LipidMAPS: LMST01040122 BioCYC: CPD-24178
7-Hexadecene Formula: C16H32 Exact Mass: 224.2504 Source ID: CNP0076332.0	CAS Registry: 18899-19-9 KEGG: LipidMAPS: BioCYC:
Formula: C50H82O22 Exact Mass: 1034.5297 Source ID: CNP0196395.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Car-3-ene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0174002.1	CAS Registry: 13466-78-9 KEGG: C09839 LipidMAPS: LMPR0102120015 BioCYC: CPD-14024
2520-38-9 Formula: C16H21NO6 Exact Mass: 323.1369 Source ID: CNP0565530.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
(S)-p-Menth-1-en-4-ol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0224794.1	CAS Registry: 2438-10-0 KEGG: LipidMAPS: BioCYC:
5-Undecene Formula: C11H22 Exact Mass: 154.1721 Source ID: CNP0245948.0	CAS Registry: 4941-53-1 KEGG: LipidMAPS: BioCYC:
Nigrumnin I Formula: C55H90O25 Exact Mass: 1150.5771 Source ID: CNP0366758.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
N-Oleoylsarcosine Formula: C21H39NO3 Exact Mass: 353.293 Source ID: CNP0442773.0	CAS Registry: 110-25-8 KEGG: LipidMAPS: BioCYC:
Pentadecanol Formula: C15H32O Exact Mass: 228.2453 Source ID: CNP0150941.0	CAS Registry: 629-76-5 KEGG: LipidMAPS: LMFA05000194 BioCYC: CPD-11595
Cystophorene Formula: C11H18 Exact Mass: 150.1408 Source ID: CNP0263390.0	CAS Registry: 16356-11-9 KEGG: LipidMAPS: BioCYC:
2-Octenal Formula: C8H14O Exact Mass: 126.1045 Source ID: CNP0192932.0	CAS Registry: 2363-89-5 KEGG: LipidMAPS: BioCYC: CPD-13323
2-Hydroxycyclopentadecanone Formula: C15H28O2 Exact Mass: 240.2089 Source ID: CNP0524324.0	CAS Registry: 4727-18-8 KEGG: LipidMAPS: BioCYC:
Methyl 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate Formula: C12H14O5 Exact Mass: 238.0841 Source ID: CNP0403791.0	CAS Registry: 20733-94-2 KEGG: LipidMAPS: BioCYC:
Formula: C25H32O12 Exact Mass: 524.1894 Source ID: CNP0221663.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Cedrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0259981.4	CAS Registry: KEGG: LipidMAPS: BioCYC:
L-Serine Formula: C3H7NO3 Exact Mass: 105.0426 Source ID: CNP0275512.1	CAS Registry: 56-45-1 KEGG: C00065 LipidMAPS: BioCYC: SER
Falcarindiol Formula: C17H24O2 Exact Mass: 260.1776 Source ID: CNP0229318.3	CAS Registry: 55297-87-5 KEGG: C08449 LipidMAPS: LMFA05000658 BioCYC:
Methyl pentadecanoate Formula: C16H32O2 Exact Mass: 256.2402 Source ID: CNP0149579.0	CAS Registry: 7132-64-1 KEGG: LipidMAPS: BioCYC:
Formula: C8H8O3 Exact Mass: 152.0473 Source ID: CNP0505262.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Carveol Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0250789.1	CAS Registry: 99-48-9 KEGG: LipidMAPS: BioCYC: Carveols
1-Butanol Formula: C4H10O Exact Mass: 74.0732 Source ID: CNP0505612.0	CAS Registry: 71-36-3 KEGG: C06142 LipidMAPS: LMFA05000109 BioCYC: BUTANOL
(1R,2S)-2,3-dihydroxy-1-(7-methoxy-2-oxo-2H-chromen-6-yl)-3-methylbutyl (2E)-2-methylbut-2-enoate Formula: C20H24O7 Exact Mass: 376.1522 Source ID: CNP0128057.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C17H24O2 Exact Mass: 260.1776 Source ID: CNP0229318.4	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C14H30O Exact Mass: 214.2297 Source ID: CNP0076547.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C10H18O3 Exact Mass: 186.1256 Source ID: CNP0193591.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Limonene-1,2-epoxide Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0230379.2	CAS Registry: 1195-92-2 KEGG: C07271 LipidMAPS: LMPR0102090015 BioCYC: 4R-Limonene-1-2-epoxides
(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:
D-Fructose Formula: C6H12O6 Exact Mass: 180.0634 Source ID: CNP0266926.3	CAS Registry: 57-48-7 KEGG: C00095 LipidMAPS: BioCYC: FRU
beta-Elemene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0176529.2	CAS Registry: 33880-83-0 KEGG: C17094 LipidMAPS: BioCYC: CPD-8232
Hinesol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0209626.2	CAS Registry: 23811-08-7 KEGG: C16970 LipidMAPS: BioCYC:
Decursinol Formula: C14H14O4 Exact Mass: 246.0892 Source ID: CNP0382038.2	CAS Registry: 23458-02-8 KEGG: C09259 LipidMAPS: BioCYC:
Degalactotigonin Formula: C50H82O22 Exact Mass: 1034.5297 Source ID: CNP0407775.2	CAS Registry: 39941-51-0 KEGG: LipidMAPS: BioCYC:
Formula: C22H22O10 Exact Mass: 446.1213 Source ID: CNP0166084.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Demethylsuberosin Formula: C14H14O3 Exact Mass: 230.0943 Source ID: CNP0307696.0	CAS Registry: 21422-04-8 KEGG: C18083 LipidMAPS: BioCYC: CPD-8192
(S)-(+)-alpha-Phellandrene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0162506.1	CAS Registry: 2243-33-6 KEGG: C11391 LipidMAPS: BioCYC: CPD-18812
Solasonine Formula: C45H73NO16 Exact Mass: 883.4929 Source ID: CNP0252414.4	CAS Registry: 19121-58-5 KEGG: C10824 LipidMAPS: BioCYC:
(S)-beta-Bisabolene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0410487.2	CAS Registry: 495-61-4 KEGG: C16775 LipidMAPS: LMPR0103060013 BioCYC:
OGRZZHTVLPTHNR-GHMZBOCLSA-N Formula: C12H22O2 Exact Mass: 198.162 Source ID: CNP0537001.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
(S)-Malate Formula: C4H6O5 Exact Mass: 134.0215 Source ID: CNP0152510.1	CAS Registry: 97-67-6 KEGG: C00149 LipidMAPS: BioCYC: MAL
Formula: [C43H49O23]+ Exact Mass: 933.2665 Source ID: CNP0567586.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
(1R,2S,5S,8S,9S,14R,15R,17R,18R,21S,24R,26S,27S)-14-chloro-5,15-dihydroxy-2,9,26-trimethyl-3,19,23,28-tetraoxaoctacyclo[16.9.1.118,27.01,5.02,24.08,17.09,14.021,26]nonacos-11-ene-4,10,22,29-tetrone Formula: C28H31ClO10 Exact Mass: 562.1606 Source ID: CNP0315735.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
beta-Eudesmol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0292043.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
Duryl aldehyde Formula: C10H12O Exact Mass: 148.0888 Source ID: CNP0085942.0	CAS Registry: 5779-72-6 KEGG: LipidMAPS: BioCYC:
(-)-Sabinene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0146195.2	CAS Registry: 10408-16-9 KEGG: C20242 LipidMAPS: LMPR0102120035 BioCYC: CPD-14012
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:
Formula: C13H20O4 Exact Mass: 240.1362 Source ID: CNP0219709.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Exaltolide Formula: C15H28O2 Exact Mass: 240.2089 Source ID: CNP0332126.0	CAS Registry: 106-02-5 KEGG: LipidMAPS: BioCYC:
D-Galacturonate Formula: C6H10O7 Exact Mass: 194.0427 Source ID: CNP0171089.4	CAS Registry: 685-73-4 KEGG: C00333 LipidMAPS: BioCYC: D-Galactopyranuronate
Formula: C29H50O Exact Mass: 414.3861 Source ID: CNP0257292.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
pentadecanethioic O-acid Formula: C15H30OS Exact Mass: 258.2017 Source ID: CNP0085720.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
(+)-Piperitol Formula: C20H20O6 Exact Mass: 356.126 Source ID: CNP0248930.1	CAS Registry: 52151-92-5 KEGG: C21954 LipidMAPS: BioCYC:
butyl octanoate Formula: C12H24O2 Exact Mass: 200.1776 Source ID: CNP0213733.0	CAS Registry: 589-75-3 KEGG: LipidMAPS: BioCYC:
(R)-2-Pentadecanol Formula: C15H32O Exact Mass: 228.2453 Source ID: CNP0286674.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
2,3,6-Trimethylbenzaldehyde Formula: C10H12O Exact Mass: 148.0888 Source ID: CNP0300217.0	CAS Registry: 34341-29-2 KEGG: LipidMAPS: BioCYC:
alpha-Cedrol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0287427.1	CAS Registry: 77-53-2 KEGG: C09631 LipidMAPS: LMPR0103690007 BioCYC:
Alanine Formula: C3H7NO2 Exact Mass: 89.0477 Source ID: CNP0313085.2	CAS Registry: 302-72-7 KEGG: C01401 LipidMAPS: BioCYC: L-ALPHA-ALANINE
beta-Himachalene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0294584.1	CAS Registry: 1461-03-6 KEGG: LipidMAPS: LMPR0103480005 BioCYC: CPD-8733
4-Ethyl-2-methoxyphenol Formula: C9H12O2 Exact Mass: 152.0837 Source ID: CNP0401902.0	CAS Registry: 2785-89-9 KEGG: LipidMAPS: BioCYC: CPD-10601
Formula: C16H30O8 Exact Mass: 350.1941 Source ID: CNP0220237.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Aromadendrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0284102.1	CAS Registry: 14682-34-9 KEGG: LipidMAPS: BioCYC: CPD-21653
7-Tetradecenol Formula: C14H28O Exact Mass: 212.214 Source ID: CNP0276887.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
N-Decane Formula: C10H22 Exact Mass: 142.1721 Source ID: CNP0279708.0	CAS Registry: 124-18-5 KEGG: LipidMAPS: LMFA11000568 BioCYC: CPD-9287
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:
(R)-gamma-Decalactone Formula: C10H18O2 Exact Mass: 170.1307 Source ID: CNP0229807.1	CAS Registry: 107797-26-2 KEGG: LipidMAPS: LMFA07040025 BioCYC:
2,4,6-Trimethylheptane Formula: C10H22 Exact Mass: 142.1721 Source ID: CNP0076048.0	CAS Registry: 2613-61-8 KEGG: LipidMAPS: BioCYC:
Acetoxyacetone Formula: C5H8O3 Exact Mass: 116.0473 Source ID: CNP0316161.0	CAS Registry: 592-20-1 KEGG: LipidMAPS: BioCYC:
acetyl aleuritolic acid Formula: C32H50O4 Exact Mass: 498.3709 Source ID: CNP0233093.1	CAS Registry: 28937-85-1 KEGG: LipidMAPS: BioCYC:
Formula: C27H30O17 Exact Mass: 626.1483 Source ID: CNP0212937.2	CAS Registry: KEGG: 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
Formula: C39H64O5 Exact Mass: 612.4753 Source ID: CNP0078377.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
102673-72-3 Formula: C12H12O3 Exact Mass: 204.0786 Source ID: CNP0264121.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C27H35NO6 Exact Mass: 469.2464 Source ID: CNP0295956.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
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
(+)-trans-Carveol Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0250789.2	CAS Registry: 18383-51-2 KEGG: C11409 LipidMAPS: BioCYC:
Formula: C27H41NO5 Exact Mass: 459.2985 Source ID: CNP0162130.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Alloocimene I Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0248120.0	CAS Registry: 673-84-7 KEGG: LipidMAPS: LMFA11000042 BioCYC:
lomatin Formula: C14H14O4 Exact Mass: 246.0892 Source ID: CNP0345452.1	CAS Registry: 5325-40-6 KEGG: LipidMAPS: BioCYC:
2,4-Decadienal Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0213382.0	CAS Registry: 2363-88-4 KEGG: LipidMAPS: BioCYC:
(2R)-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: CNP0567692.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Falcarinol Formula: C17H24O Exact Mass: 244.1827 Source ID: CNP0228485.2	CAS Registry: 21852-80-2 KEGG: C08450 LipidMAPS: LMFA05000689 BioCYC:
D-Serine Formula: C3H7NO3 Exact Mass: 105.0426 Source ID: CNP0275512.2	CAS Registry: 312-84-5 KEGG: C00740 LipidMAPS: BioCYC: D-SERINE
4-Pyridone Formula: C5H5NO Exact Mass: 95.0371 Source ID: CNP0415820.0	CAS Registry: 626-64-2 KEGG: LipidMAPS: BioCYC:
11-Hexadecen-1-ol, (11Z)- Formula: C16H32O Exact Mass: 240.2453 Source ID: CNP0183543.0	CAS Registry: 56683-54-6 KEGG: LipidMAPS: BioCYC:
6-[(3,5-dimethylphenyl)methyl]-5-ethyl-1-[[4-[2-(13-ethyl-17-hydroxy-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)ethynyl]phenyl]methoxymethyl]-4-hydroxypyrimidin-2-one Formula: C44H52N2O5 Exact Mass: 688.3876 Source ID: CNP0596682.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Cuparene Formula: C15H22 Exact Mass: 202.1721 Source ID: CNP0177283.1	CAS Registry: 16982-00-6 KEGG: LipidMAPS: LMPR0103140001 BioCYC:
DODEC-1-EN-1-OL Formula: C12H24O Exact Mass: 184.1827 Source ID: CNP0086116.0	CAS Registry: 87549-32-4 KEGG: LipidMAPS: BioCYC:
(2'Z,8'R)-2'-butylidene-8'-propyl-3H-3'-oxaspiro[2-benzofuran-1,9'-tricyclo[5.2.2.0^{1,5}]undecan]-5'-ene-3,4'-dione Formula: C24H26O4 Exact Mass: 378.1831 Source ID: CNP0321449.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
T-Muurolol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0210398.5	CAS Registry: 19912-62-0 KEGG: LipidMAPS: BioCYC:
2-Methylbutyl hexanoate Formula: C11H22O2 Exact Mass: 186.162 Source ID: CNP0257249.0	CAS Registry: 2601-13-0 KEGG: LipidMAPS: LMFA07010571 BioCYC:
Adenine Formula: C5H5N5 Exact Mass: 135.0545 Source ID: CNP0479821.0	CAS Registry: 73-24-5 KEGG: C00147 LipidMAPS: BioCYC: ADENINE
alpha-acoradiene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0222112.2	CAS Registry: 24048-44-0 KEGG: LipidMAPS: BioCYC: CPD-13268
Heptadec-8-ene Formula: C17H34 Exact Mass: 238.266 Source ID: CNP0163594.0	CAS Registry: KEGG: LipidMAPS: BioCYC: CPD-20704
Neocnidilide Formula: C12H18O2 Exact Mass: 194.1307 Source ID: CNP0267388.1	CAS Registry: 4567-33-3 KEGG: C17002 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
2-[3-[(6-imino-2-methyl-1H-pyrimidin-4-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol Formula: [C12H17N4OS]+ Exact Mass: 265.1123 Source ID: CNP0522588.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
2-methyl-4-(5-phenyl-1,2-oxazolidin-3-ylidene)cyclohexa-2,5-dien-1-one Formula: C16H15NO2 Exact Mass: 253.1103 Source ID: CNP0086471.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
tetradec-9-ene Formula: C14H28 Exact Mass: 196.2191 Source ID: CNP0076420.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
FSL0569 Formula: C19H19N7O6 Exact Mass: 441.1397 Source ID: CNP0528342.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Methyl hexanoate Formula: C7H14O2 Exact Mass: 130.0994 Source ID: CNP0192346.0	CAS Registry: 106-70-7 KEGG: LipidMAPS: LMFA07010433 BioCYC:
trans-Sabinol Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0397180.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C27H43NO3 Exact Mass: 429.3243 Source ID: CNP0278436.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
2-Methoxy-4-propylphenol Formula: C10H14O2 Exact Mass: 166.0994 Source ID: CNP0321309.0	CAS Registry: 2785-87-7 KEGG: LipidMAPS: BioCYC:
3-Butylidene-7-hydroxyphthalide Formula: C12H12O3 Exact Mass: 204.0786 Source ID: CNP0111291.0	CAS Registry: 93236-67-0 KEGG: C09921 LipidMAPS: BioCYC:
Cnidilide Formula: C12H18O2 Exact Mass: 194.1307 Source ID: CNP0199838.1	CAS Registry: 3674-03-1 KEGG: C16937 LipidMAPS: BioCYC:
Dibenzofuran Formula: C12H8O Exact Mass: 168.0575 Source ID: CNP0150070.0	CAS Registry: 132-64-9 KEGG: C07729 LipidMAPS: BioCYC: CPD-926
Formula: C45H73NO17 Exact Mass: 899.4878 Source ID: CNP0241940.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Bicyclogermacrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0196946.3	CAS Registry: 24703-35-3 KEGG: C20175 LipidMAPS: LMPR0103100001 BioCYC: CPD-13870
Pentylbenzene Formula: C11H16 Exact Mass: 148.1252 Source ID: CNP0180656.0	CAS Registry: 538-68-1 KEGG: LipidMAPS: BioCYC:
1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1aS-(1a.alpha.,4a.alpha.,7.beta.)] Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0141421.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C13H18O4 Exact Mass: 238.1205 Source ID: CNP0231832.1	CAS Registry: 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
(E)-beta-Ocimene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0509803.0	CAS Registry: 3779-61-1 KEGG: C09873 LipidMAPS: LMPR0102010021 BioCYC: CPD-4889
2,5-Dimethylocta-2,4,6-triene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0423070.0	CAS Registry: 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
Formula: C57H96O28 Exact Mass: 1228.6088 Source ID: CNP0238808.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
trans-Allo-ocimene Formula: C8H12 Exact Mass: 108.0939 Source ID: CNP0185443.0	CAS Registry: 14947-20-7 KEGG: LipidMAPS: BioCYC:
Fluorene Formula: C13H10 Exact Mass: 166.0782 Source ID: CNP0215002.0	CAS Registry: 86-73-7 KEGG: C07715 LipidMAPS: BioCYC: FLUORENE
Uttroside B Formula: C56H94O28 Exact Mass: 1214.5931 Source ID: CNP0209858.3	CAS Registry: 88048-09-3 KEGG: LipidMAPS: BioCYC: CPD-18759
Allyl benzoate Formula: C10H10O2 Exact Mass: 162.0681 Source ID: CNP0100792.0	CAS Registry: 583-04-0 KEGG: LipidMAPS: BioCYC:
1-Hexadecanol Formula: C16H34O Exact Mass: 242.261 Source ID: CNP0187598.0	CAS Registry: 36653-82-4 KEGG: C00823 LipidMAPS: LMFA05000061 BioCYC: CPD-348
(s)-(+)-2-pentadecanol Formula: C15H32O Exact Mass: 228.2453 Source ID: CNP0286674.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C27H44O3 Exact Mass: 416.329 Source ID: CNP0192382.8	CAS Registry: KEGG: LipidMAPS: BioCYC:
Bornyl acetate Formula: C12H20O2 Exact Mass: 196.1463 Source ID: CNP0222907.4	CAS Registry: 20347-65-3 KEGG: C11338 LipidMAPS: LMPR0102120020 BioCYC:
Dimethylnaphthalene Formula: C12H12 Exact Mass: 156.0939 Source ID: CNP0318754.0	CAS Registry: 575-41-7 KEGG: LipidMAPS: BioCYC:
(R)-Malate Formula: C4H6O5 Exact Mass: 134.0215 Source ID: CNP0152510.2	CAS Registry: 636-61-3 KEGG: C00497 LipidMAPS: BioCYC: CPD-660
Brefeldin A Formula: C16H24O4 Exact Mass: 280.1675 Source ID: CNP0170362.2	CAS Registry: 20350-15-6 KEGG: C73840 LipidMAPS: BioCYC:
Nodakenetin Formula: C14H14O4 Exact Mass: 246.0892 Source ID: CNP0155202.2	CAS Registry: 495-32-9 KEGG: C09278 LipidMAPS: BioCYC:
Butylphthalide Formula: C12H14O2 Exact Mass: 190.0994 Source ID: CNP0239407.1	CAS Registry: 6066-49-5 KEGG: C17854 LipidMAPS: BioCYC:
Riligustilide Formula: C24H28O4 Exact Mass: 380.1987 Source ID: CNP0216026.1	CAS Registry: 89354-45-0 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:
xi-5-Hexyldihydro-2(3H)-furanone Formula: C10H18O2 Exact Mass: 170.1307 Source ID: CNP0229807.2	CAS Registry: 706-14-9 KEGG: LipidMAPS: BioCYC:
Spathulenol Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0141421.3	CAS Registry: 6750-60-3 KEGG: LipidMAPS: BioCYC:
(1~{S})-4-isopropylidene-1,8-dimethyl-spiro[4.5]decane Formula: C15H26 Exact Mass: 206.2034 Source ID: CNP0406511.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
undecan-6-ol Formula: C11H24O Exact Mass: 172.1827 Source ID: CNP0194239.0	CAS Registry: 23708-56-7 KEGG: LipidMAPS: BioCYC:
(-)-alpha-Cuprenene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0347474.1	CAS Registry: KEGG: C20180 LipidMAPS: BioCYC: CPD-8243
Solamargine Formula: C45H73NO15 Exact Mass: 867.498 Source ID: CNP0375721.3	CAS Registry: 20311-51-7 KEGG: C10819 LipidMAPS: BioCYC:
Formula: C29H45NO5 Exact Mass: 487.3298 Source ID: CNP0321626.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
PMMLIVYPEUJENN-ZIAGYGMSSA-N Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0174878.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0196946.5	CAS Registry: KEGG: LipidMAPS: BioCYC:
Acutilobin Formula: C19H20O5 Exact Mass: 328.1311 Source ID: CNP0259557.1	CAS Registry: 130848-06-5 KEGG: LipidMAPS: BioCYC:
(rel)-(2 S,5 S)-9-[4,4-Bis-(hydroxymethyl)-5-methyl-tetrahydro-furan-2-yl]adenine Formula: C12H17N5O3 Exact Mass: 279.1331 Source ID: CNP0218830.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C17H24O Exact Mass: 244.1827 Source ID: CNP0228485.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
delta-Amorphene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0357544.1	CAS Registry: 189165-79-5 KEGG: LipidMAPS: BioCYC:
beta-Elemene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0176529.4	CAS Registry: 33880-83-0 KEGG: C17094 LipidMAPS: BioCYC: CPD-8232
gamma-Eudesmol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0267962.1	CAS Registry: 1209-71-8 KEGG: C17124 LipidMAPS: BioCYC: CPD-11433
Formula: C26H40O4 Exact Mass: 416.2926 Source ID: CNP0310747.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Globulol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0210398.6	CAS Registry: 489-41-8 KEGG: LipidMAPS: LMPR01030041 BioCYC:
4-Ethylresorcinol Formula: C8H10O2 Exact Mass: 138.0681 Source ID: CNP0279225.0	CAS Registry: 2896-60-8 KEGG: LipidMAPS: BioCYC:
Thujone Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0230379.3	CAS Registry: 546-80-5 KEGG: C09906 LipidMAPS: LMPR0102120019 BioCYC: CPD-14067
Pentadecanal Formula: C15H30O Exact Mass: 226.2297 Source ID: CNP0331942.0	CAS Registry: 2765-11-9 KEGG: C01948 LipidMAPS: LMFA06000083 BioCYC: CPD-388
Furfuryl acetate Formula: C7H8O3 Exact Mass: 140.0473 Source ID: CNP0413526.0	CAS Registry: 623-17-6 KEGG: LipidMAPS: BioCYC:
beta-acoradiene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0222112.4	CAS Registry: 28477-64-7 KEGG: LipidMAPS: BioCYC: CPD-8240
Spathulenol Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0141421.5	CAS Registry: 6750-60-3 KEGG: LipidMAPS: BioCYC:
D-2-Butylisothiocyanate Formula: C5H9NS Exact Mass: 115.0456 Source ID: CNP0416348.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
ansaspirolide Formula: C24H26O4 Exact Mass: 378.1831 Source ID: CNP0321449.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Diisobutyl phthalate Formula: C16H22O4 Exact Mass: 278.1518 Source ID: CNP0124414.0	CAS Registry: 84-69-5 KEGG: C15205 LipidMAPS: BioCYC:
RRUMKKGRKSSZKY-UHFFFAOYSA-N Formula: C5H11ClO2S Exact Mass: 170.0168 Source ID: CNP0540473.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Decursin Formula: C19H20O5 Exact Mass: 328.1311 Source ID: CNP0132518.1	CAS Registry: 5928-25-6 KEGG: C09258 LipidMAPS: BioCYC:
2-Methyl-2-cyclopenten-1-one Formula: C6H8O Exact Mass: 96.0575 Source ID: CNP0196465.0	CAS Registry: 1120-73-6 KEGG: LipidMAPS: BioCYC:
(-)-cuparene Formula: C15H22 Exact Mass: 202.1721 Source ID: CNP0177283.2	CAS Registry: KEGG: LipidMAPS: BioCYC: CPD-8244
1,7-di-epi-.beta.-Cedrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0271527.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Limonene-1,2-epoxide Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0230379.4	CAS Registry: 1195-92-2 KEGG: C07271 LipidMAPS: LMPR0102090015 BioCYC: 4R-Limonene-1-2-epoxides
Cis-5-Caffeoylquinic acid Formula: C16H18O9 Exact Mass: 354.0951 Source ID: CNP0148557.6	CAS Registry: 15016-60-1 KEGG: LipidMAPS: BioCYC:
Viridiflorol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0210398.9	CAS Registry: 552-02-3 KEGG: LipidMAPS: LMPR01030040 BioCYC: CPD-13864
Pentadecane Formula: C15H32 Exact Mass: 212.2504 Source ID: CNP0314547.0	CAS Registry: 629-62-9 KEGG: C08388 LipidMAPS: LMFA11000006 BioCYC: CPD-7946
2-Decenal Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0164061.0	CAS Registry: 3913-71-1 KEGG: LipidMAPS: LMFA06000053 BioCYC: CPD-13003
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
p-Xylene Formula: C8H10 Exact Mass: 106.0782 Source ID: CNP0227482.0	CAS Registry: 106-42-3 KEGG: C06756 LipidMAPS: BioCYC: CPD-1422
Senkyunolide Formula: C12H16O2 Exact Mass: 192.115 Source ID: CNP0290318.1	CAS Registry: 63038-10-8 KEGG: C17853 LipidMAPS: BioCYC:
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:
Tetradecane Formula: C14H30 Exact Mass: 198.2347 Source ID: CNP0293304.0	CAS Registry: 629-59-4 KEGG: LipidMAPS: LMFA11000586 BioCYC:
Nonane Formula: C9H20 Exact Mass: 128.1565 Source ID: CNP0402619.0	CAS Registry: 111-84-2 KEGG: C02445 LipidMAPS: LMFA11000579 BioCYC: CPD-9284
Formula: C56H92O28 Exact Mass: 1212.5775 Source ID: CNP0357758.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Piperonyl acetate Formula: C10H10O4 Exact Mass: 194.0579 Source ID: CNP0156240.1	CAS Registry: 326-61-4 KEGG: LipidMAPS: BioCYC:
Formula: C39H56O4 Exact Mass: 588.4178 Source ID: CNP0268363.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
2-Methylnonane Formula: C10H22 Exact Mass: 142.1721 Source ID: CNP0389961.0	CAS Registry: 871-83-0 KEGG: LipidMAPS: LMFA11000615 BioCYC:
Ethyl acetate Formula: C4H8O2 Exact Mass: 88.0524 Source ID: CNP0577601.0	CAS Registry: 141-78-6 KEGG: C00849 LipidMAPS: BioCYC: ETHYLACETATE
Pinocarveol Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0406108.2	CAS Registry: 5947-36-4 KEGG: C11941 LipidMAPS: LMPR0102120025 BioCYC:
Tiglic aldehyde Formula: C5H8O Exact Mass: 84.0575 Source ID: CNP0281160.0	CAS Registry: 497-03-0 KEGG: LipidMAPS: BioCYC:
trans-Dodec-2-enoic acid Formula: C12H22O2 Exact Mass: 198.162 Source ID: CNP0126369.0	CAS Registry: 1289-45-8 KEGG: LipidMAPS: LMFA01030788 BioCYC:
Butyl heptanoate Formula: C11H22O2 Exact Mass: 186.162 Source ID: CNP0305116.0	CAS Registry: 5454-28-4 KEGG: LipidMAPS: LMFA07010794 BioCYC:
Formula: C19H33NO2 Exact Mass: 307.2511 Source ID: CNP0141410.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Phellatin Formula: C26H30O12 Exact Mass: 534.1737 Source ID: CNP0168274.1	CAS Registry: 73140-47-3 KEGG: LipidMAPS: LMPK12111709 BioCYC:
N-Methylsolasodine Formula: C28H45NO2 Exact Mass: 427.345 Source ID: CNP0287295.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Senkyunolide h Formula: C12H16O4 Exact Mass: 224.1049 Source ID: CNP0136413.1	CAS Registry: 94596-27-7 KEGG: LipidMAPS: BioCYC:
(+)-Columbianetin Formula: C14H14O4 Exact Mass: 246.0892 Source ID: CNP0213096.1	CAS Registry: 3804-70-4 KEGG: C19707 LipidMAPS: BioCYC: CPD-9799
Formula: C9H14N4S Exact Mass: 210.0939 Source ID: CNP0326467.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
4-Decene Formula: C10H20 Exact Mass: 140.1565 Source ID: CNP0076954.0	CAS Registry: 19689-18-0 KEGG: LipidMAPS: BioCYC:
(+)-quinic acid Formula: C7H12O6 Exact Mass: 192.0634 Source ID: CNP0205647.3	CAS Registry: 36413-60-2 KEGG: LipidMAPS: BioCYC:
Formula: C8H6O3 Exact Mass: 150.0317 Source ID: CNP0305683.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
2-Cyclopenten-1-one Formula: C5H6O Exact Mass: 82.0419 Source ID: CNP0122561.0	CAS Registry: 930-30-3 KEGG: LipidMAPS: BioCYC:
Formula: C25H28O4 Exact Mass: 392.1987 Source ID: CNP0086023.0	CAS Registry: KEGG: 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
4-Isopropylbenzaldehyde Formula: C10H12O Exact Mass: 148.0888 Source ID: CNP0572774.0	CAS Registry: 122-03-2 KEGG: C06577 LipidMAPS: BioCYC: CPD-1003
53803-33-1 Formula: C10H14O Exact Mass: 150.1045 Source ID: CNP0518491.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
(-)-alpha-Pinene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0203449.2	CAS Registry: 7785-26-4 KEGG: C06308 LipidMAPS: BioCYC: CPD-4892
2-Methoxy-4-methylphenol Formula: C8H10O2 Exact Mass: 138.0681 Source ID: CNP0304667.0	CAS Registry: 93-51-6 KEGG: LipidMAPS: BioCYC:
XK-469 free acid, (R)- Formula: C17H13ClN2O4 Exact Mass: 344.0564 Source ID: CNP0080048.1	CAS Registry: 157542-91-1 KEGG: LipidMAPS: BioCYC:
(+)-Camphene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0256268.2	CAS Registry: 5794-03-6 KEGG: C06304 LipidMAPS: LMPR0102120011 BioCYC: CPD-8767
Divaricataester A Formula: C13H15NO5 Exact Mass: 265.095 Source ID: CNP0514337.0	CAS Registry: 1049708-12-4 KEGG: LipidMAPS: BioCYC:
Undecan-3-ol Formula: C11H24O Exact Mass: 172.1827 Source ID: CNP0589699.0	CAS Registry: 6929-08-4 KEGG: LipidMAPS: LMFA05000515 BioCYC:
alpha-Bulnesene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0190202.1	CAS Registry: 3691-11-0 KEGG: LipidMAPS: BioCYC: CPD-12888
4-METHYL-1-PENTEN-3-ONE Formula: C6H10O Exact Mass: 98.0732 Source ID: CNP0350661.0	CAS Registry: 1606-47-9 KEGG: LipidMAPS: BioCYC:
Nerolidol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0241588.3	CAS Registry: 7212-44-4 KEGG: C09704 LipidMAPS: LMPR0103010005 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
Myrtenol Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0246399.1	CAS Registry: 515-00-4 KEGG: C11938 LipidMAPS: LMPR0102120022 BioCYC:
Thujopsene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0223016.1	CAS Registry: 470-40-6 KEGG: C09740 LipidMAPS: LMPR0103860001 BioCYC:
p-Methoxycinnamic acid ethyl ester Formula: C12H14O3 Exact Mass: 206.0943 Source ID: CNP0454043.0	CAS Registry: 1929-30-2 KEGG: C10476 LipidMAPS: BioCYC:
Isospathulenol Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0255464.1	CAS Registry: 88395-46-4 KEGG: LipidMAPS: BioCYC:
Ledene oxide-(I) Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0152416.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
2-Hexadecen-1-ol Formula: C16H32O Exact Mass: 240.2453 Source ID: CNP0586462.0	CAS Registry: 22104-83-2 KEGG: LipidMAPS: BioCYC:
Diacetone alcohol Formula: C6H12O2 Exact Mass: 116.0837 Source ID: CNP0333881.0	CAS Registry: 123-42-2 KEGG: LipidMAPS: LMFA12000071 BioCYC:
Globulol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0210398.13	CAS Registry: 489-41-8 KEGG: LipidMAPS: LMPR01030041 BioCYC:
Formula: C27H41NO5 Exact Mass: 459.2985 Source ID: CNP0162130.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Myrcene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0388953.0	CAS Registry: 123-35-3 KEGG: C06074 LipidMAPS: LMPR0102010005 BioCYC: CPD-4888
Butyl hexanoate Formula: C10H20O2 Exact Mass: 172.1463 Source ID: CNP0132269.0	CAS Registry: 626-82-4 KEGG: LipidMAPS: LMFA07010436 BioCYC:
Formula: C39H63NO11 Exact Mass: 721.4401 Source ID: CNP0140612.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
(3R)-1-hexen-3-ol Formula: C6H12O Exact Mass: 100.0888 Source ID: CNP0193104.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C28H30O12 Exact Mass: 558.1737 Source ID: CNP0256490.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
(4S)-tetradecan-4-ol Formula: C14H30O Exact Mass: 214.2297 Source ID: CNP0076547.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Tigogenin Formula: C27H44O3 Exact Mass: 416.329 Source ID: CNP0192382.12	CAS Registry: 77-60-1 KEGG: C08914 LipidMAPS: LMST01080009 BioCYC:
1-Tridecene Formula: C13H26 Exact Mass: 182.2034 Source ID: CNP0324663.0	CAS Registry: 2437-56-1 KEGG: LipidMAPS: LMFA11000331 BioCYC:
p-menth-8-en-3-one Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0179926.2	CAS Registry: 29606-79-9 KEGG: LipidMAPS: BioCYC:
Hexyl benzoate Formula: C13H18O2 Exact Mass: 206.1307 Source ID: CNP0219505.0	CAS Registry: 6789-88-4 KEGG: C14716 LipidMAPS: 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
Formula: C33H40O21 Exact Mass: 772.2062 Source ID: CNP0248495.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C20H22O8 Exact Mass: 390.1315 Source ID: CNP0152881.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
2-Carene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0263147.2	CAS Registry: 4497-92-1 KEGG: LipidMAPS: BioCYC: CPD-4901
C20180 Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0347474.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
(3S,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-4,6,8-trien-1-ol Formula: C20H32O Exact Mass: 288.2453 Source ID: CNP0344125.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
302912-17-0 Formula: C24H48O2 Exact Mass: 368.3654 Source ID: CNP0560839.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Rosifoliol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0155436.1	CAS Registry: 63891-61-2 KEGG: LipidMAPS: BioCYC:
4-Hydroxyphenacyl alcohol Formula: C8H8O3 Exact Mass: 152.0473 Source ID: CNP0183122.0	CAS Registry: 5706-85-4 KEGG: C13635 LipidMAPS: BioCYC:
cis-p-Menth-1-en-3-ol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0246159.3	CAS Registry: 16721-38-3 KEGG: LipidMAPS: BioCYC:
Ethanol Formula: C2H6O Exact Mass: 46.0419 Source ID: CNP0546367.0	CAS Registry: 64-17-5 KEGG: C00469 LipidMAPS: BioCYC: ETOH
Formula: C27H43NO4 Exact Mass: 445.3192 Source ID: CNP0372903.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C27H43NO4 Exact Mass: 445.3192 Source ID: CNP0372903.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
Agarospirol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0209626.6	CAS Registry: 1460-73-7 KEGG: LipidMAPS: BioCYC:
(1~{S},2~{S},3~{R},4~{S},6~{R},8~{S})-8-isopropyl-1,2-dimethyl-tetracyclo[4.4.0.0^{2,4}.0^{3,7}]decane Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0203771.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
(-)-alpha-Gurjunene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0256345.1	CAS Registry: 489-40-7 KEGG: C19734 LipidMAPS: BioCYC: CPD-12891
Octanal Formula: C8H16O Exact Mass: 128.1201 Source ID: CNP0146292.0	CAS Registry: 124-13-0 KEGG: C01545 LipidMAPS: LMFA06000028 BioCYC: CPD-371
Bornyl acetate Formula: C12H20O2 Exact Mass: 196.1463 Source ID: CNP0222907.7	CAS Registry: 20347-65-3 KEGG: C11338 LipidMAPS: LMPR0102120020 BioCYC:
L-Ornithine Formula: C5H12N2O2 Exact Mass: 132.0899 Source ID: CNP0102727.1	CAS Registry: 70-26-8 KEGG: C00077 LipidMAPS: BioCYC: ORNITHINE
delta-Amorphene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0357544.2	CAS Registry: 189165-79-5 KEGG: LipidMAPS: BioCYC:
Formula: C22H22O9 Exact Mass: 430.1264 Source ID: CNP0232489.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
Guaiol acetate Formula: C17H28O2 Exact Mass: 264.2089 Source ID: CNP0393462.1	CAS Registry: 134-28-1 KEGG: LipidMAPS: BioCYC:
Carveol Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0250789.3	CAS Registry: 99-48-9 KEGG: LipidMAPS: BioCYC: Carveols
alpha-acoradiene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0228927.1	CAS Registry: 24048-44-0 KEGG: LipidMAPS: BioCYC: CPD-13268
(1,1,2,2-tetradeuterio-2-hydroxy-ethyl)-tris(trideuteriomethyl)ammonium Formula: [C5H14NO]+ Exact Mass: 104.1075 Source ID: CNP0509176.0	CAS Registry: 71709-72-3 KEGG: LipidMAPS: BioCYC:
AKOS032949091 Formula: C24H28O4 Exact Mass: 380.1987 Source ID: CNP0216026.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
(+)-.gamma.-Gurjunene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0163747.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C16H20O9 Exact Mass: 356.1107 Source ID: CNP0536156.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
1-(2-hydroxyphenyl)pentan-1-one Formula: C11H14O2 Exact Mass: 178.0994 Source ID: CNP0481328.0	CAS Registry: 18430-91-6 KEGG: LipidMAPS: BioCYC:
Formula: C24H26O4 Exact Mass: 378.1831 Source ID: CNP0321449.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
Benzyl isothiocyanate Formula: C8H7NS Exact Mass: 149.0299 Source ID: CNP0088598.0	CAS Registry: 622-78-6 KEGG: C03098 LipidMAPS: BioCYC: BENZYL-ISOTHIOCYANATE
.alpha.-Acoradiene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0171491.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
QSPL 173 Formula: C30H50 Exact Mass: 410.3912 Source ID: CNP0365938.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
D-Threonine Formula: C4H9NO3 Exact Mass: 119.0582 Source ID: CNP0361197.4	CAS Registry: 632-20-2 KEGG: C00820 LipidMAPS: BioCYC: D-THREONINE
Tridecane Formula: C13H28 Exact Mass: 184.2191 Source ID: CNP0251262.0	CAS Registry: 629-50-5 KEGG: C13834 LipidMAPS: LMFA11000001 BioCYC: CPD-7949
Progenin II Formula: C39H62O12 Exact Mass: 722.4241 Source ID: CNP0140612.2	CAS Registry: 32449-98-2 KEGG: LipidMAPS: LMST01080055 BioCYC:
Dodecane Formula: C12H26 Exact Mass: 170.2034 Source ID: CNP0299960.0	CAS Registry: 112-40-3 KEGG: C08374 LipidMAPS: LMFA11000004 BioCYC: CPD-9290
1-Dodecene Formula: C12H24 Exact Mass: 168.1878 Source ID: CNP0173522.0	CAS Registry: 112-41-4 KEGG: LipidMAPS: LMFA11000313 BioCYC:
tartaric acid Formula: C4H6O6 Exact Mass: 150.0164 Source ID: CNP0253398.0	CAS Registry: 133-37-9 KEGG: C00898 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
Formula: C9H14 Exact Mass: 122.1095 Source ID: CNP0343796.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
1H-Pyrrole-2-carboxaldehyde Formula: C5H5NO Exact Mass: 95.0371 Source ID: CNP0105766.0	CAS Registry: 1003-29-8 KEGG: LipidMAPS: BioCYC:
3,5-Dimethoxytoluene Formula: C9H12O2 Exact Mass: 152.0837 Source ID: CNP0159302.0	CAS Registry: 4179-19-5 KEGG: LipidMAPS: BioCYC: CPD-9502
Phthalic anhydride Formula: C8H4O3 Exact Mass: 148.016 Source ID: CNP0332462.0	CAS Registry: 85-44-9 KEGG: LipidMAPS: BioCYC:
Phthalide Formula: C8H6O2 Exact Mass: 134.0368 Source ID: CNP0263138.0	CAS Registry: 87-41-2 KEGG: C09921 LipidMAPS: BioCYC:
Physalin F Formula: C28H30O10 Exact Mass: 526.1839 Source ID: CNP0177011.4	CAS Registry: 57423-71-9 KEGG: 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
(E)-5-Undecen-3-yne Formula: C11H18 Exact Mass: 150.1408 Source ID: CNP0109430.0	CAS Registry: 74744-31-3 KEGG: LipidMAPS: BioCYC:
beta-Cedrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0271527.2	CAS Registry: 546-28-1 KEGG: LipidMAPS: BioCYC: CPD-8777
senkyunolide I Formula: C12H16O4 Exact Mass: 224.1049 Source ID: CNP0136413.2	CAS Registry: 94596-28-8 KEGG: LipidMAPS: BioCYC:
Formula: C36H58O6 Exact Mass: 586.4233 Source ID: CNP0134788.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Nigrumnin II Formula: C55H88O27 Exact Mass: 1180.5513 Source ID: CNP0204137.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
SOLANIGROSIDE G Formula: C50H82O23 Exact Mass: 1050.5247 Source ID: CNP0327701.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Limonene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0282017.2	CAS Registry: 138-86-3 KEGG: C06078 LipidMAPS: BioCYC: Limonenes
Formula: C56H94O29 Exact Mass: 1230.588 Source ID: CNP0298033.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
(+)-3-Carene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0174002.2	CAS Registry: 498-15-7 KEGG: C11382 LipidMAPS: LMPR0102120021 BioCYC: CPD-8756
Formula: C21H34O11 Exact Mass: 462.2101 Source ID: CNP0250317.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Phthalate Formula: C8H6O4 Exact Mass: 166.0266 Source ID: CNP0324589.0	CAS Registry: 88-99-3 KEGG: C01606 LipidMAPS: BioCYC:
p-Hydroxyphenethyl trans-ferulate Formula: C18H18O5 Exact Mass: 314.1154 Source ID: CNP0257636.0	CAS Registry: 84873-15-4 KEGG: LipidMAPS: BioCYC:
alpha-Alaskene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0228927.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
2-Methylbenzyl radical Formula: C8H9 Exact Mass: 105.0704 Source ID: CNP0546829.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
(-)-trans-Carveol Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0250789.4	CAS Registry: 2102-58-1 KEGG: C00964 LipidMAPS: LMPR0102090005 BioCYC:
beta-Butyrolactone Formula: C4H6O2 Exact Mass: 86.0368 Source ID: CNP0232064.1	CAS Registry: 3068-88-0 KEGG: C19201 LipidMAPS: BioCYC:
(2S)-2-[[4-[[(6R)-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: CNP0567692.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
(-)-alpha-Pinene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0203449.3	CAS Registry: 7785-26-4 KEGG: C06308 LipidMAPS: BioCYC: CPD-4892
beta-Cedrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0271527.3	CAS Registry: 546-28-1 KEGG: LipidMAPS: BioCYC: CPD-8777
1-[(2R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-hydroxypyrimidin-2-one Formula: C9H12N2O6 Exact Mass: 244.0695 Source ID: CNP0553636.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
Oplopandiol Formula: C17H26O2 Exact Mass: 262.1933 Source ID: CNP0253824.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C50H82O22 Exact Mass: 1034.5297 Source ID: CNP0407775.4	CAS Registry: KEGG: LipidMAPS: BioCYC:
gamma-Nonalactone Formula: C9H16O2 Exact Mass: 156.115 Source ID: CNP0388431.2	CAS Registry: 104-61-0 KEGG: C08501 LipidMAPS: LMFA07040021 BioCYC:
Phthalate Formula: C8H6O4 Exact Mass: 166.0266 Source ID: CNP0530779.0	CAS Registry: 88-99-3 KEGG: C01606 LipidMAPS: BioCYC:
Linalyl acetate Formula: C12H20O2 Exact Mass: 196.1463 Source ID: CNP0150444.2	CAS Registry: 115-95-7 KEGG: C09863 LipidMAPS: LMPR0102010009 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:
2-methyldodecan-5-one Formula: C13H26O Exact Mass: 198.1984 Source ID: CNP0130630.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Solasodine Formula: C27H43NO2 Exact Mass: 413.3294 Source ID: CNP0120841.8	CAS Registry: 126-17-0 KEGG: C10822 LipidMAPS: LMST01150004 BioCYC: CPD-13080
3-Ethylphenol Formula: C8H10O Exact Mass: 122.0732 Source ID: CNP0135916.0	CAS Registry: 620-17-7 KEGG: C14386 LipidMAPS: BioCYC:
(-)-alpha-Terpineol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0311257.2	CAS Registry: 10482-56-1 KEGG: C11393 LipidMAPS: BioCYC: CPD-4887
Carveol Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0250789.5	CAS Registry: 99-48-9 KEGG: LipidMAPS: BioCYC: Carveols
Physalin G Formula: C28H30O10 Exact Mass: 526.1839 Source ID: CNP0309327.1	CAS Registry: 76045-38-0 KEGG: LipidMAPS: BioCYC:
Formula: C27H42O3 Exact Mass: 414.3134 Source ID: CNP0192744.11	CAS Registry: KEGG: LipidMAPS: BioCYC:
(-)-Caryophyllene Oxide Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0274815.7	CAS Registry: 1139-30-6 KEGG: LipidMAPS: BioCYC:
beta-Cubebene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0198091.3	CAS Registry: 13744-15-5 KEGG: C09648 LipidMAPS: LMPR0103440002 BioCYC: CPD-8803
Formula: C7H12O Exact Mass: 112.0888 Source ID: CNP0489135.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Falcarindiol Formula: C17H24O2 Exact Mass: 260.1776 Source ID: CNP0229318.5	CAS Registry: 55297-87-5 KEGG: C08449 LipidMAPS: LMFA05000658 BioCYC:
1-Phenyl-1-pentanone Formula: C11H14O Exact Mass: 162.1045 Source ID: CNP0346038.0	CAS Registry: 1009-14-9 KEGG: LipidMAPS: BioCYC: CPD-23537
(-)-beta-Phellandrene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0204388.1	CAS Registry: 6153-17-9 KEGG: C11392 LipidMAPS: BioCYC: CPD-8768
(E)-Thujopsene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0223016.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0287427.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
Dihydropinosylvin Formula: C14H14O2 Exact Mass: 214.0994 Source ID: CNP0165480.0	CAS Registry: 14531-52-3 KEGG: C10254 LipidMAPS: LMPK13090034 BioCYC: CPD-6963
Vitamin B15 Formula: C10H19NO8 Exact Mass: 281.1111 Source ID: CNP0085965.1	CAS Registry: 20858-86-0 KEGG: LipidMAPS: BioCYC:
(+)-.beta.-Funebrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0271527.4	CAS Registry: KEGG: LipidMAPS: BioCYC:
681238-02-8 Formula: C18H26O3 Exact Mass: 290.1882 Source ID: CNP0213366.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
trans-.alpha.-Bergamotol Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0135331.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Spathulenol Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0141421.6	CAS Registry: 6750-60-3 KEGG: 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:
Viridiflorene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0233156.2	CAS Registry: 21747-46-6 KEGG: C20162 LipidMAPS: BioCYC: CPD-13857
Phthalate Formula: C8H6O4 Exact Mass: 166.0266 Source ID: CNP0482841.0	CAS Registry: 88-99-3 KEGG: C01606 LipidMAPS: BioCYC:
D-Ornithine Formula: C5H12N2O2 Exact Mass: 132.0899 Source ID: CNP0102727.2	CAS Registry: 348-66-3 KEGG: C00515 LipidMAPS: BioCYC: CPD-217
beta-acoradiene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0228927.3	CAS Registry: 28477-64-7 KEGG: LipidMAPS: BioCYC: CPD-8240
(1S,3R,4R,5R)-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxy-cyclohexanecarboxylic acid Formula: C16H18O9 Exact Mass: 354.0951 Source ID: CNP0148557.14	CAS Registry: 327-97-9 KEGG: 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
Aromadendrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0284102.7	CAS Registry: 14682-34-9 KEGG: LipidMAPS: BioCYC: CPD-21653
1-Tetradecene Formula: C14H28 Exact Mass: 196.2191 Source ID: CNP0137398.0	CAS Registry: 1120-36-1 KEGG: LipidMAPS: LMFA11000329 BioCYC:
(R)-hydratropic acid Formula: C9H10O2 Exact Mass: 150.0681 Source ID: CNP0118710.1	CAS Registry: 7782-26-5 KEGG: LipidMAPS: BioCYC:
Falcarindiol Formula: C17H24O2 Exact Mass: 260.1776 Source ID: CNP0229318.6	CAS Registry: 55297-87-5 KEGG: C08449 LipidMAPS: LMFA05000658 BioCYC:
(+)-Piperitol Formula: C20H20O6 Exact Mass: 356.126 Source ID: CNP0248930.5	CAS Registry: 52151-92-5 KEGG: C21954 LipidMAPS: BioCYC:
Bicycloelemene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0282481.2	CAS Registry: 32531-56-9 KEGG: LipidMAPS: BioCYC:
Uralene Formula: C21H20O7 Exact Mass: 384.1209 Source ID: CNP0314314.0	CAS Registry: 150853-99-9 KEGG: LipidMAPS: LMPK12111615 BioCYC:
1,3,4,5-tetrahydro-2-benzofuran-1,3-dione Formula: C8H6O3 Exact Mass: 150.0317 Source ID: CNP0113734.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Isononane Formula: C9H20 Exact Mass: 128.1565 Source ID: CNP0161146.0	CAS Registry: 3221-61-2 KEGG: LipidMAPS: BioCYC:
beta-Chamigrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0243325.1	CAS Registry: 18431-82-8 KEGG: C09637 LipidMAPS: BioCYC:
Crinamine Formula: C17H19NO4 Exact Mass: 301.1314 Source ID: CNP0225067.5	CAS Registry: 639-41-8 KEGG: C08525 LipidMAPS: BioCYC:
2,4-Dimethylbenzaldehyde Formula: C9H10O Exact Mass: 134.0732 Source ID: CNP0194374.0	CAS Registry: 15764-16-6 KEGG: LipidMAPS: BioCYC:
Cyclopentadecanone Formula: C15H28O Exact Mass: 224.214 Source ID: CNP0222423.0	CAS Registry: 502-72-7 KEGG: LipidMAPS: BioCYC:
alpha-Eudesmol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0106573.4	CAS Registry: 473-16-5 KEGG: C09663 LipidMAPS: BioCYC: CPD-11430
[(9Z,11S,16R)-11,16-dihydroxyoctadeca-9,17-dien-12,14-diynyl] acetate Formula: C20H28O4 Exact Mass: 332.1987 Source ID: CNP0262321.1	CAS Registry: 213905-35-2 KEGG: LipidMAPS: BioCYC:
2,3-Dimethylphenol Formula: C8H10O Exact Mass: 122.0732 Source ID: CNP0282533.0	CAS Registry: 526-75-0 KEGG: LipidMAPS: BioCYC:
(+/-)-[R-(E)]-5-Isopropyl-8-methylnona-6,8-dien-2-one Formula: C13H22O Exact Mass: 194.1671 Source ID: CNP0166773.1	CAS Registry: 2278-53-7 KEGG: LipidMAPS: BioCYC:
p-Cumic alcohol Formula: C10H14O Exact Mass: 150.1045 Source ID: CNP0157328.0	CAS Registry: 536-60-7 KEGG: C06576 LipidMAPS: BioCYC: CPD-1002
41563-11-5 Formula: C35H68O4 Exact Mass: 552.5117 Source ID: CNP0121331.0	CAS Registry: 29899-13-6 KEGG: LipidMAPS: BioCYC:
5-Isopropyl-2-methylphenol acetate Formula: C12H16O2 Exact Mass: 192.115 Source ID: CNP0225898.0	CAS Registry: 6380-28-5 KEGG: LipidMAPS: BioCYC:
103839-19-6 Formula: C23H24O13 Exact Mass: 508.1217 Source ID: CNP0186787.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
(+)-beta-Caryophyllene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0212910.9	CAS Registry: 10579-93-8 KEGG: C19973 LipidMAPS: BioCYC:
2-Methylfuran Formula: C5H6O Exact Mass: 82.0419 Source ID: CNP0204821.0	CAS Registry: 534-22-5 KEGG: LipidMAPS: BioCYC:
Aromadendrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0284102.8	CAS Registry: 14682-34-9 KEGG: LipidMAPS: BioCYC: CPD-21653
Isoprenyl alcohol Formula: C5H10O Exact Mass: 86.0732 Source ID: CNP0337361.0	CAS Registry: 115-18-4 KEGG: C21402 LipidMAPS: BioCYC: CPD-13614
Indolyl-3-ethanol acetate Formula: C12H13NO2 Exact Mass: 203.0946 Source ID: CNP0178753.0	CAS Registry: 13137-14-9 KEGG: LipidMAPS: BioCYC:
Guaiol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0189004.3	CAS Registry: 489-86-1 KEGG: C09676 LipidMAPS: LMPR0103410007 BioCYC:
3-(butan-2-ylidene)-1,3-dihydro-2-benzofuran-1-one Formula: C12H12O2 Exact Mass: 188.0837 Source ID: CNP0423675.0	CAS Registry: 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
Formula: C30H50 Exact Mass: 410.3912 Source ID: CNP0291370.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
alpha-acoradiene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0228927.4	CAS Registry: 24048-44-0 KEGG: LipidMAPS: BioCYC: CPD-13268
Formula: C17H16O5 Exact Mass: 300.0998 Source ID: CNP0075975.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Uracil Formula: C4H4N2O2 Exact Mass: 112.0273 Source ID: CNP0482999.0	CAS Registry: 66-22-8 KEGG: C00106 LipidMAPS: BioCYC: URACIL
P-Meth-1-en-4-OL Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0224794.2	CAS Registry: 20126-76-5 KEGG: LipidMAPS: BioCYC:
6-Undecanone Formula: C11H22O Exact Mass: 170.1671 Source ID: CNP0003552.0	CAS Registry: 927-49-1 KEGG: LipidMAPS: LMFA12000062 BioCYC:
SOLANIGROSIDE H Formula: C51H82O22 Exact Mass: 1046.5297 Source ID: CNP0306436.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
2-Methyldecane Formula: C11H24 Exact Mass: 156.1878 Source ID: CNP0188292.0	CAS Registry: 6975-98-0 KEGG: LipidMAPS: BioCYC:
(+)-Thujopsene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0223016.3	CAS Registry: 470-40-6 KEGG: C20724 LipidMAPS: BioCYC: CPD-8236
.beta.-Cuprenene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0188471.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Isopropyl hexanoate Formula: C9H18O2 Exact Mass: 158.1307 Source ID: CNP0202716.0	CAS Registry: 2311-46-8 KEGG: LipidMAPS: LMFA07010676 BioCYC:
17243-64-0 Formula: C14H22N2O3S Exact Mass: 298.1351 Source ID: CNP0502849.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
4-Octanone Formula: C8H16O Exact Mass: 128.1201 Source ID: CNP0094009.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
(r)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)-2-methoxyethyl]acrylamide Formula: C19H21NO5 Exact Mass: 343.142 Source ID: CNP0586868.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Falcarinol Formula: C17H24O Exact Mass: 244.1827 Source ID: CNP0228485.4	CAS Registry: 21852-80-2 KEGG: C08450 LipidMAPS: LMFA05000689 BioCYC:
Formula: C12H14O2 Exact Mass: 190.0994 Source ID: CNP0076620.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C45H73NO17 Exact Mass: 899.4878 Source ID: CNP0258396.1	CAS Registry: 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:
Pinocarveol Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0406108.3	CAS Registry: 5947-36-4 KEGG: C11941 LipidMAPS: LMPR0102120025 BioCYC:
2,5-Dimethylstyrene Formula: C10H12 Exact Mass: 132.0939 Source ID: CNP0039391.0	CAS Registry: 2039-89-6 KEGG: LipidMAPS: BioCYC:
2-Methylnaphthalene Formula: C11H10 Exact Mass: 142.0782 Source ID: CNP0213194.0	CAS Registry: 91-57-6 KEGG: C14098 LipidMAPS: BioCYC: CPD-22755
Thujopsene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0223016.4	CAS Registry: 470-40-6 KEGG: C09740 LipidMAPS: LMPR0103860001 BioCYC:
(-)-alpha-Gurjunene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0256345.2	CAS Registry: 489-40-7 KEGG: C19734 LipidMAPS: BioCYC: CPD-12891
SOLANIGROSIDE E Formula: C55H88O28 Exact Mass: 1196.5462 Source ID: CNP0422396.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
(S)-2-Methylbutanal Formula: C5H10O Exact Mass: 86.0732 Source ID: CNP0220551.1	CAS Registry: 1730-97-8 KEGG: LipidMAPS: BioCYC:
p-Menthene Formula: C10H18 Exact Mass: 138.1408 Source ID: CNP0287005.1	CAS Registry: 1195-31-9 KEGG: LipidMAPS: BioCYC:
Formula: C24H28O4 Exact Mass: 380.1987 Source ID: CNP0216026.3	CAS Registry: 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
Peucedanone Formula: C14H14O5 Exact Mass: 262.0841 Source ID: CNP0132618.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
dodecyl group Formula: C12H25 Exact Mass: 169.1956 Source ID: CNP0562200.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
6-methoxycoumarin Formula: C10H8O3 Exact Mass: 176.0473 Source ID: CNP0309169.0	CAS Registry: 17372-53-1 KEGG: LipidMAPS: BioCYC:
senkyunolide I Formula: C12H16O4 Exact Mass: 224.1049 Source ID: CNP0136413.3	CAS Registry: 94596-28-8 KEGG: LipidMAPS: BioCYC:
Allo-Aromadendrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0284102.10	CAS Registry: 25246-27-9 KEGG: LipidMAPS: LMPR0103430003 BioCYC:
Formula: C45H73NO15 Exact Mass: 867.498 Source ID: CNP0213318.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
4-Pentylphenol Formula: C11H16O Exact Mass: 164.1201 Source ID: CNP0317854.0	CAS Registry: 14938-35-3 KEGG: C14466 LipidMAPS: BioCYC:
Graveolone Formula: C14H12O4 Exact Mass: 244.0736 Source ID: CNP0206675.0	CAS Registry: 16499-05-1 KEGG: LipidMAPS: BioCYC:
Formula: C16H30O8 Exact Mass: 350.1941 Source ID: CNP0220237.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C13H18O4 Exact Mass: 238.1205 Source ID: CNP0231832.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
(-)-Columbianetin Formula: C14H14O4 Exact Mass: 246.0892 Source ID: CNP0213096.2	CAS Registry: 52842-47-4 KEGG: C09210 LipidMAPS: BioCYC:
SOLANIGROSIDE D Formula: C55H88O27 Exact Mass: 1180.5513 Source ID: CNP0224283.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
(+)-Linalool Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0373115.2	CAS Registry: 126-90-9 KEGG: C11389 LipidMAPS: BioCYC: CPD-8997
Stigmasterol Formula: C29H48O Exact Mass: 412.3705 Source ID: CNP0389131.24	CAS Registry: 83-48-7 KEGG: C05442 LipidMAPS: LMST01040123 BioCYC: CPD-4162
Formula: C45H73NO15 Exact Mass: 867.498 Source ID: CNP0375721.7	CAS Registry: KEGG: LipidMAPS: BioCYC:
Verbenone Formula: C10H14O Exact Mass: 150.1045 Source ID: CNP0109275.2	CAS Registry: 18309-32-5 KEGG: C09913 LipidMAPS: BioCYC:
Myrtenal Formula: C10H14O Exact Mass: 150.1045 Source ID: CNP0386447.2	CAS Registry: 23727-16-4 KEGG: C11939 LipidMAPS: LMPR0102120023 BioCYC:
beta-Sesquiphellandrene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0176634.5	CAS Registry: 20307-83-9 KEGG: C16776 LipidMAPS: BioCYC: CPD-8247
beta-acoradiene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0222112.5	CAS Registry: 28477-64-7 KEGG: LipidMAPS: BioCYC: CPD-8240
Limonene-1,2-epoxide Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0230379.9	CAS Registry: 1195-92-2 KEGG: C07271 LipidMAPS: LMPR0102090015 BioCYC: 4R-Limonene-1-2-epoxides
Bornyl acetate Formula: C12H20O2 Exact Mass: 196.1463 Source ID: CNP0222907.10	CAS Registry: 20347-65-3 KEGG: C11338 LipidMAPS: LMPR0102120020 BioCYC:
2-Carene Formula: C10H16 Exact Mass: 136.1252 Source ID: CNP0263147.3	CAS Registry: 4497-92-1 KEGG: LipidMAPS: BioCYC: CPD-4901
Bornyl acetate Formula: C12H20O2 Exact Mass: 196.1463 Source ID: CNP0222907.11	CAS Registry: 20347-65-3 KEGG: C11338 LipidMAPS: LMPR0102120020 BioCYC:
Levistolide A Formula: C24H28O4 Exact Mass: 380.1987 Source ID: CNP0302489.1	CAS Registry: 89708-23-6 KEGG: LipidMAPS: BioCYC:
Isobutyl isobutyrate Formula: C8H16O2 Exact Mass: 144.115 Source ID: CNP0146650.0	CAS Registry: 97-85-8 KEGG: LipidMAPS: LMFA07010566 BioCYC:
Uridine Formula: C9H12N2O6 Exact Mass: 244.0695 Source ID: CNP0230441.2	CAS Registry: 58-96-8 KEGG: C00299 LipidMAPS: BioCYC: URIDINE
S,S-Dimethyl-beta-propiothetin Formula: C5H10O2S Exact Mass: 134.0401 Source ID: CNP0152869.0	CAS Registry: 7314-30-9 KEGG: C04022 LipidMAPS: BioCYC: SS-DIMETHYL-BETA-PROPIOTHETIN
Formula: C21H24O8 Exact Mass: 404.1471 Source ID: CNP0182384.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Uridine Formula: C9H12N2O6 Exact Mass: 244.0695 Source ID: CNP0230441.4	CAS Registry: 58-96-8 KEGG: C00299 LipidMAPS: BioCYC: URIDINE
2-[3-[(6-amino-2-methyl-4-pyrimidinyl)methyl]-4-methyl-5-thiazol-3-iumyl]ethanol Formula: C12H17N4OS Exact Mass: 265.1123 Source ID: CNP0515461.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
(+)-Sinaspirolide Formula: C24H26O4 Exact Mass: 378.1831 Source ID: CNP0152777.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C17H20O4 Exact Mass: 288.1362 Source ID: CNP0118378.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
ansaspirolide Formula: C24H26O4 Exact Mass: 378.1831 Source ID: CNP0321449.4	CAS Registry: KEGG: LipidMAPS: BioCYC:
methylhydroxycarbene Formula: C2H4O Exact Mass: 44.0262 Source ID: CNP0601692.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
CHEMBL3970351 Formula: C36H42O6 Exact Mass: 570.2981 Source ID: CNP0500204.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
methyl (1S,1'R,2R,4'R,5'R,7R)-4-oxo-1'-pentanoyl-5'-propylspiro[3,8,9-trioxatricyclo[5.2.2.01,5]undec-5-ene-2,6'-bicyclo[2.2.2]oct-2-ene]-2'-carboxylate Formula: C25H32O7 Exact Mass: 444.2148 Source ID: CNP0512791.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Asperphenone B Formula: C16H14O6 Exact Mass: 302.079 Source ID: CNP0425215.0	CAS Registry: KEGG: LipidMAPS: BioCYC: