(Q105136726)

English

3-Acetyloxy-3-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-oxo-1,4,5,6,6a,7,8,8a,11,12-decahydropicene-4a-carboxylic acid

group of stereoisomers with the chemical formula C₃₂H₄₆O₆

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Statements

group of stereoisomers

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oleanane triterpenoid

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oleanane triterpenoid

526.3294391919999 dalton

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based on heuristic

inferred from InChI

chemical formula

C₃₂H₄₆O₆

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canonical SMILES

O=C(OC1(O)CC2(C(=O)O)C(=C3C=CC4C5(C)CCC(=O)C(C)(C)C5CCC4(C)C3(C)CC2)CC1(C)C)C

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Identifiers

InChI=1S/C32H46O6/c1-19(33)38-32(37)18-31(25(35)36)16-15-29(7)20(21(31)17-26(32,2)3)9-10-23-28(6)13-12-24(34)27(4,5)22(28)11-14-30(23,29)8/h9-10,22-23,37H,11-18H2,1-8H3,(H,35,36)

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JXQWECUYHGGLLB-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

JXQWECUYHGGLLB-UHFFFAOYSA-N

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