(Q104994089)

English

5,6,8a-trimethyl-5-[2-(5-oxo-2H-furan-3-yl)ethyl]-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid

group of stereoisomers with the chemical formula C₂₀H₂₈O₄

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Statements

group of stereoisomers

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clerodane diterpenoid

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clerodane diterpenoid

332.19875937599994 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₈O₄

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canonical SMILES

O=C(O)C1=CCCC2C1(C)CCC(C)C2(C)CCC3=CC(=O)OC3

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Identifiers

InChI=1S/C20H28O4/c1-13-7-9-20(3)15(18(22)23)5-4-6-16(20)19(13,2)10-8-14-11-17(21)24-12-14/h5,11,13,16H,4,6-10,12H2,1-3H3,(H,22,23)

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FEOFLRVZBOQGQA-UHFFFAOYSA-N

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based on heuristic

inferred from InChIKey

matched by identifier from

FEOFLRVZBOQGQA-UHFFFAOYSA-N

UniChem compound ID

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