Arnebia euchroma (species) - 数据之源，洞见之始

Arnebia euchroma

ncbi_taxid: 373122 - Arnebia euchroma(species); all_childs:

taxonomy name: Arnebia euchroma (species)
ancestor: Arnebia (genus)

Child Taxonomy

taxonomy name	rank	note

Enzyme Proteins

protein id	name	ec_number	function

Metabolites

LCMS Annotations

Literature Annotations

Metabolite	Database Reference	Structure
Ferulate Formula: C10H10O4 Exact Mass: 194.0579 Source ID: CNP0304940.0	CAS Registry: 537-98-4 KEGG: C01494 LipidMAPS: BioCYC: FERULIC-ACID
beta-Caryophyllene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0212910.1	CAS Registry: 87-44-5 KEGG: C09629 LipidMAPS: LMPR0103120001 BioCYC: CPD-8230
(-)-Caryophyllene Oxide Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0274815.1	CAS Registry: 1139-30-6 KEGG: LipidMAPS: BioCYC:
Ergosta-4,6,8(14),22-tetraen-3-one Formula: C28H40O Exact Mass: 392.3079 Source ID: CNP0193956.1	CAS Registry: 19254-69-4 KEGG: LipidMAPS: BioCYC:
Hexadecanoic acid Formula: C16H32O2 Exact Mass: 256.2402 Source ID: CNP0420987.0	CAS Registry: 57-10-3 KEGG: C00249 LipidMAPS: LMFA01010001 BioCYC: PALMITATE
Methyleugenol Formula: C11H14O2 Exact Mass: 178.0994 Source ID: CNP0137352.0	CAS Registry: 93-15-2 KEGG: C10454 LipidMAPS: BioCYC: CPD-6482
(+)-Camphor Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0273956.1	CAS Registry: 464-49-3 KEGG: C00808 LipidMAPS: LMPR0102120001 BioCYC: CPD-862
Phenylacetaldehyde Formula: C8H8O Exact Mass: 120.0575 Source ID: CNP0175320.0	CAS Registry: 122-78-1 KEGG: C00601 LipidMAPS: BioCYC: PHENYLACETALDEHYDE
Phenylethyl alcohol Formula: C8H10O Exact Mass: 122.0732 Source ID: CNP0402269.0	CAS Registry: 60-12-8 KEGG: C05853 LipidMAPS: BioCYC: CPD-7035
Anethole Formula: C10H12O Exact Mass: 148.0888 Source ID: CNP0402035.0	CAS Registry: 4180-23-8 KEGG: C10428 LipidMAPS: BioCYC: CPD-9930
beta-Ionone Formula: C13H20O Exact Mass: 192.1514 Source ID: CNP0261884.0	CAS Registry: 79-77-6 KEGG: C12287 LipidMAPS: BioCYC: CPD-7204
2-Acetylpyrrole Formula: C6H7NO Exact Mass: 109.0528 Source ID: CNP0200282.0	CAS Registry: 1072-83-9 KEGG: LipidMAPS: BioCYC:
Methyl linoleate Formula: C19H34O2 Exact Mass: 294.2559 Source ID: CNP0199763.0	CAS Registry: 112-63-0 KEGG: LipidMAPS: BioCYC:
Pentanoate Formula: C5H10O2 Exact Mass: 102.0681 Source ID: CNP0144818.0	CAS Registry: 109-52-4 KEGG: C00803 LipidMAPS: LMFA01010005 BioCYC:
Methyl oleate Formula: C19H36O2 Exact Mass: 296.2715 Source ID: CNP0185882.0	CAS Registry: 112-62-9 KEGG: C03425 LipidMAPS: LMFA07010965 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
Serotonin Formula: C10H12N2O Exact Mass: 176.095 Source ID: CNP0110235.0	CAS Registry: 50-67-9 KEGG: C00780 LipidMAPS: BioCYC: SEROTONIN
Decanoic acid Formula: C10H20O2 Exact Mass: 172.1463 Source ID: CNP0213238.0	CAS Registry: 334-48-5 KEGG: C01571 LipidMAPS: LMFA01010010 BioCYC: CPD-3617
Furfural Formula: C5H4O2 Exact Mass: 96.0211 Source ID: CNP0178160.0	CAS Registry: 98-01-1 KEGG: C14279 LipidMAPS: BioCYC: CPD0-2357
Eugenol Formula: C10H12O2 Exact Mass: 164.0837 Source ID: CNP0134292.0	CAS Registry: 97-53-0 KEGG: C10453 LipidMAPS: BioCYC: CPD-6481
1,4-Naphthoquinone Formula: C10H6O2 Exact Mass: 158.0368 Source ID: CNP0388462.0	CAS Registry: 130-15-4 KEGG: C02617 LipidMAPS: BioCYC: CPD0-954
Formula: C30H48O Exact Mass: 424.3705 Source ID: CNP0223675.1	CAS Registry: KEGG: 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
Torulene Formula: C40H54 Exact Mass: 534.4225 Source ID: CNP0181334.0	CAS Registry: 547-23-9 KEGG: C08613 LipidMAPS: LMPR01070088 BioCYC: CPD-7953
Hexacosyl trans-ferulate Formula: C36H62O4 Exact Mass: 558.4648 Source ID: CNP0379893.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Octacosyl ferulate Formula: C38H66O4 Exact Mass: 586.4961 Source ID: CNP0180930.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Methyl decanoate Formula: C11H22O2 Exact Mass: 186.162 Source ID: CNP0223324.0	CAS Registry: 110-42-9 KEGG: LipidMAPS: LMFA07010454 BioCYC:
Lithospermic acid Formula: C27H22O12 Exact Mass: 538.1111 Source ID: CNP0227703.1	CAS Registry: 28831-65-4 KEGG: C08745 LipidMAPS: BioCYC:
(R)-2-methylbutyric acid Formula: C5H10O2 Exact Mass: 102.0681 Source ID: CNP0187792.1	CAS Registry: 32231-50-8 KEGG: LipidMAPS: BioCYC:
Paeonol Formula: C9H10O3 Exact Mass: 166.063 Source ID: CNP0324617.0	CAS Registry: 552-41-0 KEGG: C10712 LipidMAPS: BioCYC:
(S)-1-Phenylethanol Formula: C8H10O Exact Mass: 122.0732 Source ID: CNP0207239.1	CAS Registry: 1445-91-6 KEGG: C11348 LipidMAPS: BioCYC:
(-)-Borneol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0259481.4	CAS Registry: 464-45-9 KEGG: C01766 LipidMAPS: LMPR0102120004 BioCYC: CPD-1908
Rosmarinate Formula: C18H16O8 Exact Mass: 360.0845 Source ID: CNP0243825.3	CAS Registry: 20283-92-5 KEGG: C01850 LipidMAPS: BioCYC: CPD-6981
methyl palmitoleate Formula: C17H32O2 Exact Mass: 268.2402 Source ID: CNP0246101.0	CAS Registry: 1120-25-8 KEGG: LipidMAPS: BioCYC:
Tryptamine Formula: C10H12N2 Exact Mass: 160.1 Source ID: CNP0329876.0	CAS Registry: 61-54-1 KEGG: C00398 LipidMAPS: BioCYC: TRYPTAMINE
Methyl tetradecanoate Formula: C15H30O2 Exact Mass: 242.2246 Source ID: CNP0250171.0	CAS Registry: 124-10-7 KEGG: LipidMAPS: LMFA07010467 BioCYC:
Methyl palmitate Formula: C17H34O2 Exact Mass: 270.2559 Source ID: CNP0274232.0	CAS Registry: 112-39-0 KEGG: C16995 LipidMAPS: LMFA07010470 BioCYC: Methylhexadecanoates
Selina-3,7(11)-diene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0190107.1	CAS Registry: 6813-21-4 KEGG: LipidMAPS: BioCYC:
Formula: C16H14O4 Exact Mass: 270.0892 Source ID: CNP0321465.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
2-ethyl-2-methyl-butanoic acid Formula: C7H14O2 Exact Mass: 130.0994 Source ID: CNP0454868.0	CAS Registry: 19889-37-3 KEGG: LipidMAPS: LMFA01020146 BioCYC:
Shikonin Formula: C16H16O5 Exact Mass: 288.0998 Source ID: CNP0315575.1	CAS Registry: 517-89-5 KEGG: C17412 LipidMAPS: BioCYC: CPD-9322
[(1~{R},18~{R},22~{S})-6,8,11,12,13-pentahydroxy-3,7,16-trioxo-21,22-bis[(3,4,5-trihydroxybenzoyl)oxy]-2,17,20-trioxatetracyclo[16.3.1.0^{4,9}.0^{10,15}]docosa-5,8,10,12,14-pentaen-19-yl]methyl 3,4,5-trihydroxybenzoate Formula: C41H30O26 Exact Mass: 938.1025 Source ID: CNP0163606.1	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
Formula: C18H20O5 Exact Mass: 316.1311 Source ID: CNP0171981.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Cinnamaldehyde Formula: C9H8O Exact Mass: 132.0575 Source ID: CNP0279382.0	CAS Registry: 104-55-2 KEGG: C00903 LipidMAPS: BioCYC: CINNAMALDEHYDE
Deoxyshikonin Formula: C16H16O4 Exact Mass: 272.1049 Source ID: CNP0323854.0	CAS Registry: 43043-74-9 KEGG: C18133 LipidMAPS: BioCYC: CPD-9321
Formula: C17H26O4 Exact Mass: 294.1831 Source ID: CNP0198169.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
(5~{a}~{R},6~{S},13~{S},13~{a}~{S})-1,4,8,11-tetrahydroxy-6,13-bis(2-methylprop-1-enyl)-5~{a},6,13,13~{a}-tetrahydropentacene-5,7,12,14-tetrone Formula: C30H26O8 Exact Mass: 514.1628 Source ID: CNP0223462.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Isocaryophyllene oxide Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0274815.4	CAS Registry: KEGG: LipidMAPS: BioCYC:
(1R)-1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-4-methylpent-3-en-1-yl 3-(acetyloxy)-3-methylbutanoate Formula: C23H26O8 Exact Mass: 430.1628 Source ID: CNP0153496.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C21H26O5 Exact Mass: 358.178 Source ID: CNP0296263.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
(-)-Borneol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0259481.6	CAS Registry: 464-45-9 KEGG: C01766 LipidMAPS: LMPR0102120004 BioCYC: CPD-1908
(+)-Camphor Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0273956.2	CAS Registry: 464-49-3 KEGG: C00808 LipidMAPS: LMPR0102120001 BioCYC: CPD-862
Tetracosyl ferulate Formula: C34H58O4 Exact Mass: 530.4335 Source ID: CNP0139406.0	CAS Registry: KEGG: LipidMAPS: 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
(4R)-14,16-dihydroxy-4-methyl-3-oxabicyclo[10.4.0]hexadeca-1(12),13,15-trien-2-one Formula: C16H22O4 Exact Mass: 278.1518 Source ID: CNP0170371.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Tiglic acid Formula: C5H8O2 Exact Mass: 100.0524 Source ID: CNP0238363.0	CAS Registry: 80-59-1 KEGG: C08279 LipidMAPS: LMFA01020030 BioCYC: CPD-7077
Methyl hexanoate Formula: C7H14O2 Exact Mass: 130.0994 Source ID: CNP0192346.0	CAS Registry: 106-70-7 KEGG: LipidMAPS: LMFA07010433 BioCYC:
Arnebinol Formula: C16H20O2 Exact Mass: 244.1463 Source ID: CNP0131096.0	CAS Registry: 87064-17-3 KEGG: C09917 LipidMAPS: BioCYC:
[(1R)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] 3-hydroxy-3-methylbutanoate Formula: C21H24O7 Exact Mass: 388.1522 Source ID: CNP0180027.1	CAS Registry: 7415-78-3 KEGG: LipidMAPS: BioCYC:
Methyl linolenate Formula: C19H32O2 Exact Mass: 292.2402 Source ID: CNP0108916.0	CAS Registry: 301-00-8 KEGG: LipidMAPS: BioCYC:
potassium;sodium;4-[(2~{R})-2-carboxy-2-[(1~{R})-3-[(1~{R})-1-carboxy-2-(3-hydroxy-4-oxido-phenyl)ethoxy]carbonyl-1-(3,4-dihydroxyphenyl)-6-hydroxy-7-[(2~{S},3~{R},4~{S},5~{S},6~{R})-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-1,2-dihydronaphthalene-2-carbonyl]oxy-ethyl]-2-hydroxy-phenolate Formula: C42H38KNaO21 Exact Mass: 940.144 Source ID: CNP0448548.1	CAS Registry: 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:
(R)-1-(5,8-Dihydroxy-1,4-dioxo-1,4-dihydro-2-naphthyl)-4-methyl-3-pentenyl isovalerate Formula: C21H24O6 Exact Mass: 372.1573 Source ID: CNP0193745.1	CAS Registry: 52387-14-1 KEGG: LipidMAPS: BioCYC:
PMMLIVYPEUJENN-ZIAGYGMSSA-N Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0174878.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
14,16-dihydroxy-3-oxabicyclo[10.4.0]hexadeca-1(12),13,15-trien-2-one Formula: C15H20O4 Exact Mass: 264.1362 Source ID: CNP0076248.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
(-)-Borneol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0259481.8	CAS Registry: 464-45-9 KEGG: C01766 LipidMAPS: LMPR0102120004 BioCYC: CPD-1908
Propionylshikonin Formula: C19H20O6 Exact Mass: 344.126 Source ID: CNP0206733.1	CAS Registry: 162283-70-7 KEGG: LipidMAPS: BioCYC:
2-Acetylfuran Formula: C6H6O2 Exact Mass: 110.0368 Source ID: CNP0350272.0	CAS Registry: 1192-62-7 KEGG: LipidMAPS: BioCYC:
2-Methylpropanoate Formula: C4H8O2 Exact Mass: 88.0524 Source ID: CNP0197560.0	CAS Registry: 79-31-2 KEGG: C02632 LipidMAPS: LMFA01020071 BioCYC: ISOBUTYRATE
Lithospermic acid Formula: C27H22O12 Exact Mass: 538.1111 Source ID: CNP0227703.2	CAS Registry: 28831-65-4 KEGG: C08745 LipidMAPS: BioCYC:
(-)-Borneol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0259481.9	CAS Registry: 464-45-9 KEGG: C01766 LipidMAPS: LMPR0102120004 BioCYC: CPD-1908
Lithospermic acid Formula: C27H22O12 Exact Mass: 538.1111 Source ID: CNP0227703.3	CAS Registry: 28831-65-4 KEGG: C08745 LipidMAPS: BioCYC:
CID 74421150 Formula: C22H24O4 Exact Mass: 352.1675 Source ID: CNP0601038.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Camphor Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0273956.5	CAS Registry: 464-49-3 KEGG: C00808 LipidMAPS: BioCYC:
disodium;4-[(2~{R})-2-carboxy-2-[(1~{R})-3-[(1~{R})-1-carboxy-2-(3-hydroxy-4-oxido-phenyl)ethoxy]carbonyl-1-(3,4-dihydroxyphenyl)-6,7-dihydroxy-1,2-dihydronaphthalene-2-carbonyl]oxy-ethyl]-2-hydroxy-phenolate Formula: C36H28Na2O16 Exact Mass: 762.1173 Source ID: CNP0254054.3	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C36H29KO16 Exact Mass: 756.1093 Source ID: CNP0254054.4	CAS Registry: KEGG: LipidMAPS: BioCYC:
10307-61-6 Formula: C7H14O2 Exact Mass: 130.0994 Source ID: CNP0105613.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Formula: C21H26O5 Exact Mass: 358.178 Source ID: CNP0144658.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Acetylshikonin Formula: C18H18O6 Exact Mass: 330.1103 Source ID: CNP0258683.1	CAS Registry: 24502-78-1 KEGG: C17413 LipidMAPS: BioCYC: CPD-19545
Borneol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0259481.10	CAS Registry: 507-70-0 KEGG: C01411 LipidMAPS: LMPR0102120004 BioCYC:
Phenanthrene Formula: C14H10 Exact Mass: 178.0782 Source ID: CNP0176203.0	CAS Registry: 85-01-8 KEGG: C11422 LipidMAPS: BioCYC: CPD-13485
2-[4-(4-methylpent-3-en-1-yl)furan-2-yl]cyclohexa-2,5-diene-1,4-dione Formula: C16H16O3 Exact Mass: 256.1099 Source ID: CNP0316467.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
Echinone Formula: C19H20O6 Exact Mass: 344.126 Source ID: CNP0144692.2	CAS Registry: 80348-65-8 KEGG: C10338 LipidMAPS: BioCYC:
African-5-ene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0376317.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Alkannin Formula: C16H16O5 Exact Mass: 288.0998 Source ID: CNP0315575.2	CAS Registry: 517-88-4 KEGG: C10292 LipidMAPS: BioCYC:
Acetylshikonin Formula: C18H18O6 Exact Mass: 330.1103 Source ID: CNP0258683.2	CAS Registry: 24502-78-1 KEGG: C17413 LipidMAPS: BioCYC: CPD-19545
Stigmast-4-ene-3,6-dione Formula: C29H46O2 Exact Mass: 426.3498 Source ID: CNP0327368.2	CAS Registry: 57458-57-8 KEGG: LipidMAPS: BioCYC:
Formula: C21H20O12 Exact Mass: 464.0955 Source ID: CNP0375678.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
(+)-Rabdosiin Formula: C36H30O16 Exact Mass: 718.1534 Source ID: CNP0254054.6	CAS Registry: 119152-54-4 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
(R)-Alpha-Methylbutyryl Alkannin Formula: C21H24O6 Exact Mass: 372.1573 Source ID: CNP0182889.2	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
,-Dimethylacrylalkannin Formula: C21H22O6 Exact Mass: 370.1416 Source ID: CNP0086062.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Jacarandic acid Formula: C30H48O5 Exact Mass: 488.3502 Source ID: CNP0186530.10	CAS Registry: 13850-16-3 KEGG: LipidMAPS: BioCYC:
(-)-Borneol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0259481.11	CAS Registry: 464-45-9 KEGG: C01766 LipidMAPS: LMPR0102120004 BioCYC: CPD-1908
214779-01-8 Formula: C18H26O4 Exact Mass: 306.1831 Source ID: CNP0156979.0	CAS Registry: KEGG: LipidMAPS: BioCYC:
(-)-alpha-Isocomene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0293033.1	CAS Registry: 65372-78-3 KEGG: C20477 LipidMAPS: BioCYC:
(+)-Rabdosiin Formula: C36H30O16 Exact Mass: 718.1534 Source ID: CNP0254054.7	CAS Registry: 119152-54-4 KEGG: LipidMAPS: BioCYC:
(S)-alpha-Methylbutyryl alkannin Formula: C21H24O6 Exact Mass: 372.1573 Source ID: CNP0182889.3	CAS Registry: 52387-15-2 KEGG: LipidMAPS: BioCYC:
(-)-Borneol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0259481.12	CAS Registry: 464-45-9 KEGG: C01766 LipidMAPS: LMPR0102120004 BioCYC: CPD-1908
(-)-Caryophyllene Oxide Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0274815.7	CAS Registry: 1139-30-6 KEGG: LipidMAPS: BioCYC:
Borneol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0259481.13	CAS Registry: 507-70-0 KEGG: C01411 LipidMAPS: LMPR0102120004 BioCYC:
1-Phenylethanol Formula: C8H10O Exact Mass: 122.0732 Source ID: CNP0207239.2	CAS Registry: 98-85-1 KEGG: C07112 LipidMAPS: BioCYC:
Methyl stearate Formula: C19H38O2 Exact Mass: 298.2872 Source ID: CNP0105908.0	CAS Registry: 112-61-8 KEGG: LipidMAPS: LMFA07010474 BioCYC:
Formula: C13H19NO3 Exact Mass: 237.1365 Source ID: CNP0296237.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
beta,beta-Dimethylacrylshikonin Formula: C21H22O6 Exact Mass: 370.1416 Source ID: CNP0209621.1	CAS Registry: 24502-79-2 KEGG: C17415 LipidMAPS: BioCYC:
beta,beta-Dimethylacrylshikonin Formula: C21H22O6 Exact Mass: 370.1416 Source ID: CNP0209621.2	CAS Registry: 24502-79-2 KEGG: C17415 LipidMAPS: BioCYC:
de-O-methyllasiodiplodin Formula: C16H22O4 Exact Mass: 278.1518 Source ID: CNP0170371.2	CAS Registry: 32885-82-8 KEGG: LipidMAPS: BioCYC:
Formula: C23H26O6 Exact Mass: 398.1729 Source ID: CNP0163639.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
(-)-Camphor Formula: C10H16O Exact Mass: 152.1201 Source ID: CNP0273956.6	CAS Registry: 464-48-2 KEGG: C00809 LipidMAPS: LMPR0102120001 BioCYC: Camphor
alpha-Eudesmol Formula: C15H26O Exact Mass: 222.1984 Source ID: CNP0106573.4	CAS Registry: 473-16-5 KEGG: C09663 LipidMAPS: BioCYC: CPD-11430
Thiophene Formula: C4H4S Exact Mass: 84.0034 Source ID: CNP0604134.0	CAS Registry: 110-02-1 KEGG: C02595 LipidMAPS: BioCYC:
(+)-beta-Caryophyllene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0212910.9	CAS Registry: 10579-93-8 KEGG: C19973 LipidMAPS: BioCYC:
Formula: C18H22O4 Exact Mass: 302.1518 Source ID: CNP0336819.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Salvianolic acid B Formula: C36H30O16 Exact Mass: 718.1534 Source ID: CNP0222282.10	CAS Registry: 121521-90-2 KEGG: LipidMAPS: BioCYC:
Salvianolic acid B Formula: C36H30O16 Exact Mass: 718.1534 Source ID: CNP0222282.11	CAS Registry: 121521-90-2 KEGG: LipidMAPS: BioCYC:
Borneol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0259481.15	CAS Registry: 507-70-0 KEGG: C01411 LipidMAPS: LMPR0102120004 BioCYC:
Shikometabolin A Formula: C32H28O9 Exact Mass: 556.1733 Source ID: CNP0570931.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
3,4-(Methylenedioxy)Cinnamoyl Alkannin Formula: C26H22O8 Exact Mass: 462.1315 Source ID: CNP0340039.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Methyl heptanoate Formula: C8H16O2 Exact Mass: 144.115 Source ID: CNP0149439.0	CAS Registry: 106-73-0 KEGG: LipidMAPS: LMFA07010961 BioCYC:
beta-Selinene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0178641.5	CAS Registry: 17066-67-0 KEGG: C09723 LipidMAPS: LMPR0103190014 BioCYC: CPD-11504
Isovaleryl Alkannin Formula: C21H24O6 Exact Mass: 372.1573 Source ID: CNP0193745.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
2-Butenoic acid, 2-methyl-, 2,3,5,7a-tetrahydro-7-(hydroxymethyl)-1H-pyrrolizin-1-yl ester, [1S-[1.alpha.(Z),7a.alpha.]]- Formula: C13H19NO3 Exact Mass: 237.1365 Source ID: CNP0244343.2	CAS Registry: 6922-62-9 KEGG: LipidMAPS: BioCYC:
(-)-Borneol Formula: C10H18O Exact Mass: 154.1358 Source ID: CNP0259481.16	CAS Registry: 464-45-9 KEGG: C01766 LipidMAPS: LMPR0102120004 BioCYC: CPD-1908
Caryophyllene oxide 2 Formula: C15H24O Exact Mass: 220.1827 Source ID: CNP0274815.8	CAS Registry: KEGG: LipidMAPS: BioCYC:
Isobutylshikonin Formula: C20H22O6 Exact Mass: 358.1416 Source ID: CNP0292284.1	CAS Registry: 52438-12-7 KEGG: C17414 LipidMAPS: BioCYC:
(R)-1-(5,8-Dihydroxy-1,4-dioxo-1,4-dihydro-2-naphthyl)-4-methyl-3-pentenyl isovalerate Formula: C21H24O6 Exact Mass: 372.1573 Source ID: CNP0182889.4	CAS Registry: 52387-14-1 KEGG: LipidMAPS: BioCYC:
gamma-Selinene Formula: C15H24 Exact Mass: 204.1878 Source ID: CNP0190107.4	CAS Registry: 515-17-3 KEGG: LipidMAPS: BioCYC: CPD-20249
Isobutylshikonin Formula: C20H22O6 Exact Mass: 358.1416 Source ID: CNP0292284.2	CAS Registry: 52438-12-7 KEGG: C17414 LipidMAPS: BioCYC:
Formula: C22H26O6 Exact Mass: 386.1729 Source ID: CNP0096210.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
Cinnamoyl Alkannin Formula: C25H22O6 Exact Mass: 418.1416 Source ID: CNP0078236.1	CAS Registry: KEGG: LipidMAPS: BioCYC:
2-Butenoic acid, 2-methyl-, 2,3,5,7a-tetrahydro-7-(hydroxymethyl)-1H-pyrrolizin-1-yl ester, [1S-[1.alpha.(Z),7a.alpha.]]- Formula: C13H19NO3 Exact Mass: 237.1365 Source ID: CNP0296237.2	CAS Registry: 6922-62-9 KEGG: LipidMAPS: BioCYC:
69091-17-4 Formula: C23H26O8 Exact Mass: 430.1628 Source ID: CNP0153496.2	CAS Registry: KEGG: LipidMAPS: BioCYC:
Naphthazarin Formula: C10H6O4 Exact Mass: 190.0266 Source ID: CNP0290261.0	CAS Registry: 475-38-7 KEGG: C01938 LipidMAPS: BioCYC: CPD-19245
Arnebinone Formula: C18H22O4 Exact Mass: 302.1518 Source ID: CNP0336819.3	CAS Registry: 87255-09-2 KEGG: C10302 LipidMAPS: BioCYC: