(Q105339707)

English

(1R,2R,4aR,5S,8aR)-2-hydroxy-5-[(3S)-5-hydroxy-3-methylpentyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid

chemical compound

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default values for all languages

No label defined

No description defined

Statements

type of chemical entity

0 references

2-hydroxy-5-(5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

338.245709568 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₄O₄

0 references

canonical SMILES

O=C(O)C1(C)C(O)CCC2(C)C(C(=C)CCC12)CCC(C)CCO

0 references

isomeric SMILES

C=C1CC[C@@H]2[C@](C)(CC[C@@H](O)[C@]2(C)C(=O)O)[C@H]1CC[C@H](C)CCO

0 references

Juniperus thurifera

1 reference

Labdane acids from polar extracts of Juniperus thurifera

Identifiers

InChI=1S/C20H34O4/c1-13(10-12-21)5-7-15-14(2)6-8-16-19(15,3)11-9-17(22)20(16,4)18(23)24/h13,15-17,21-22H,2,5-12H2,1,3-4H3,(H,23,24)/t13-,15-,16+,17+,19+,20+/m0/s1

0 references

XQHSNLWCJZCSBW-ANWDPNSXSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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