(Q110172957)

English

2-(3-Hydroxy-4a,6a,6b,8a,11,11,14a-heptamethyl-1,2,3,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-hexadecahydropicen-4-yl)acetic acid

group of stereoisomers with the chemical formula C₃₁H₅₂O₃

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

472.391645524 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₅₂O₃

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canonical SMILES

O=C(O)CC1C(O)CCC2C1(C)CCC3C2(C)CCC4(C)C5CC(C)(C)CCC5(C)CCC34C

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found in taxon

Garcia parviflora

1 reference

stated in

Triterpenes from Garcia parviflora. Cytotoxic evaluation of natural and semisynthetic friedelanes.

Identifiers

InChI

InChI=1S/C31H52O3/c1-26(2)12-13-27(3)14-16-30(6)23-10-11-28(4)20(18-25(33)34)21(32)8-9-22(28)29(23,5)15-17-31(30,7)24(27)19-26/h20-24,32H,8-19H2,1-7H3,(H,33,34)

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InChIKey

MCQITBJTZHPOCF-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MCQITBJTZHPOCF-UHFFFAOYSA-N

(Q110172957)

2-(3-Hydroxy-4a,6a,6b,8a,11,11,14a-heptamethyl-1,2,3,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-hexadecahydropicen-4-yl)acetic acid

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Identifiers

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