(Q82981707)

English

9-Hydroxy-2,7,7,8-tetramethyl-4-methylidene-1,2,4,5,6,6a,7,7a-octahydro-3H-cyclopropa[3,4]cyclohepta[1,2-e]inden-3-one

group of stereoisomers with the chemical formula C₂₀H₂₄O₂

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Statements

group of stereoisomers

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jatropholane diterpenoid

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jatropholane diterpenoid

296.177630008 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₀H₂₄O₂

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canonical SMILES

O=C1C2=C3C(=C)CCC4C(C3=C(C(O)=C2CC1C)C)C4(C)C

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isomeric SMILES

C=C1CCC2C(c3c(C)c(O)c4c(c31)C(=O)[C@@H](C)C4)C2(C)C

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Chemical constituents from leaves of Jatropha curcas

Identifiers

InChI=1S/C20H24O2/c1-9-6-7-13-17(20(13,4)5)15-11(3)19(22)12-8-10(2)18(21)16(12)14(9)15/h10,13,17,22H,1,6-8H2,2-5H3/t10-,13?,17?/m0/s1

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BMHPRIPRPDSKRK-ITNLDZRZSA-N

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CAS Registry Number

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26 December 2021

UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

DTXCID801418864

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