(Q105122434)

English

3-[3-Hydroxy-2,3-dimethyl-6-(1-oxopropan-2-ylidene)-2-(4,8,12-trimethyltrideca-3,7,11-trienyl)cyclohexyl]propyl decanoate

group of stereoisomers with the chemical formula C₄₀H₆₈O₄

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Statements

group of stereoisomers

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iridal triterpenoid

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iridal triterpenoid

612.511760656 dalton

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based on heuristic

inferred from InChI

chemical formula

C₄₀H₆₈O₄

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canonical SMILES

O=CC(=C1CCC(O)(C)C(C)(CCC=C(C)CCC=C(C)CCC=C(C)C)C1CCCOC(=O)CCCCCCCCC)C

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Identifiers

InChI=1S/C40H68O4/c1-9-10-11-12-13-14-15-26-38(42)44-30-19-25-37-36(35(6)31-41)27-29-40(8,43)39(37,7)28-18-24-34(5)23-17-22-33(4)21-16-20-32(2)3/h20,22,24,31,37,43H,9-19,21,23,25-30H2,1-8H3

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IXRANGUGSVRSRI-UHFFFAOYSA-N

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1 reference

based on heuristic

inferred from InChIKey

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