(Q105234017)

English

4-[7-(3,7-Dimethylocta-2,6-dienyl)-6,8-dihydroxy-17,17-dimethyl-5-(3-methylbut-2-enyl)-10,14-dioxo-3,16-dioxapentacyclo[11.4.1.02,11.02,15.04,9]octadeca-4,6,8,11-tetraen-15-yl]-2-methylbut-2-enoic acid

group of stereoisomers with the chemical formula C₃₈H₄₆O₈

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Statements

instance of

group of stereoisomers

0 references

subclass of

2,6-dimethyloctane monoterpenoid

1 reference

inferred from

2,6-dimethyloctane monoterpenoid

mass

630.3192684320001 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₈H₄₆O₈

0 references

canonical SMILES

O=C(O)C(=CCC12OC(C)(C)C3CC(C=C4C(=O)C=5C(O)=C(C(O)=C(C5OC431)CC=C(C)C)CC=C(C)CCC=C(C)C)C2=O)C

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found in taxon

Garcinia

1 reference

stated in

Cytotoxic polyprenylated xanthones from the resin of Garcinia hanburyi

Identifiers

InChI

InChI=1S/C38H46O8/c1-20(2)10-9-11-22(5)13-15-25-30(39)26(14-12-21(3)4)33-29(31(25)40)32(41)27-18-24-19-28-36(7,8)46-37(34(24)42,38(27,28)45-33)17-16-23(6)35(43)44/h10,12-13,16,18,24,28,39-40H,9,11,14-15,17,19H2,1-8H3,(H,43,44)

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InChIKey

RCWNBHCZYXWDOV-UHFFFAOYSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

1 reference

Human Metabolome Database ID

HMDB0252605

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

RCWNBHCZYXWDOV-UHFFFAOYSA-N

(Q105234017)

4-[7-(3,7-Dimethylocta-2,6-dienyl)-6,8-dihydroxy-17,17-dimethyl-5-(3-methylbut-2-enyl)-10,14-dioxo-3,16-dioxapentacyclo[11.4.1.02,11.02,15.04,9]octadeca-4,6,8,11-tetraen-15-yl]-2-methylbut-2-enoic acid

Statements

Identifiers

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