(Q104999793)

English

10-[3-(3,4-Dihydroxyphenyl)prop-2-enoyloxy]-2,2,6b,9,9,12a,14a-heptamethyl-1,3,4,5,6a,7,8,8a,10,11,12,13,14,14b-tetradecahydropicene-4a-carboxylic acid

group of stereoisomers with the chemical formula C₃₉H₅₄O₆

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instance of

group of stereoisomers

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subclass of

taraxerane triterpenoid

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inferred from

taraxerane triterpenoid

1 reference

618.3920394480001 dalton

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based on heuristic

inferred from InChI

chemical formula

C₃₉H₅₄O₆

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canonical SMILES

O=C(OC1CCC2(C)C3CCC4(C(=CCC5(C(=O)O)CCC(C)(C)CC45)C3(C)CCC2C1(C)C)C)C=CC6=CC=C(O)C(O)=C6

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Identifiers

InChI

InChI=1S/C39H54O6/c1-34(2)20-21-39(33(43)44)19-14-29-37(6)16-12-27-35(3,4)31(45-32(42)11-9-24-8-10-25(40)26(41)22-24)15-18-36(27,5)28(37)13-17-38(29,7)30(39)23-34/h8-11,14,22,27-28,30-31,40-41H,12-13,15-21,23H2,1-7H3,(H,43,44)

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InChIKey

FQQJILVEMCMTND-UHFFFAOYSA-N

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PubChem CID

85155631

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

FQQJILVEMCMTND-UHFFFAOYSA-N

(Q104999793)

10-[3-(3,4-Dihydroxyphenyl)prop-2-enoyloxy]-2,2,6b,9,9,12a,14a-heptamethyl-1,3,4,5,6a,7,8,8a,10,11,12,13,14,14b-tetradecahydropicene-4a-carboxylic acid

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