(Q105380512)

English

(1S,4S,5R,9S,10R,13R,14S)-5,9-dimethyl-14-(3-methylbutanoyloxymethyl)tetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

5,9-Dimethyl-14-(3-methylbutanoyloxymethyl)tetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

404.29265976 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₄₀O₄

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canonical SMILES

O=C(OCC1CC23CCC4C(C(=O)O)(C)CCCC4(C)C3CCC1C2)CC(C)C

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isomeric SMILES

CC(C)CC(=O)OC[C@H]1C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(=O)O)[C@@H]2CC[C@@H]1C3

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found in taxon

Eleutherococcus trifoliatus

1 reference

stated in

Lupane-Triterpene Carboxylic Acids from the Leaves of Acanthopanax trifoliatus.

Panax trifoliatus

1 reference

stated in

In vitro anti-adhesive activity of an acidic polysaccharide from Panax ginseng on Porphyromonas gingivalis binding to erythrocytes

Identifiers

InChI

InChI=1S/C25H40O4/c1-16(2)12-21(26)29-15-18-14-25-11-8-19-23(3,20(25)7-6-17(18)13-25)9-5-10-24(19,4)22(27)28/h16-20H,5-15H2,1-4H3,(H,27,28)/t17-,18-,19+,20+,23-,24-,25+/m1/s1

0 references

InChIKey

ZOILZTWSQHWPGH-NHEUJGHNSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZOILZTWSQHWPGH-NHEUJGHNSA-N

(Q105380512)

(1S,4S,5R,9S,10R,13R,14S)-5,9-dimethyl-14-(3-methylbutanoyloxymethyl)tetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid

Statements

Identifiers

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