(Q104376070)

English

[2-Methyl-4-oxo-3-[(2Z)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate

group of stereoisomers with the chemical formula C₂₂H₂₈O₅

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Statements

instance of

group of stereoisomers

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subclass of

cyclopropane monoterpenoid

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inferred from

cyclopropane monoterpenoid

mass

372.193673996 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₂H₂₈O₅

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canonical SMILES

O=C(OC)C(=CC1C(C(=O)OC2C(=C(C(=O)C2)CC=CC=C)C)C1(C)C)C

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isomeric SMILES

C=C/C=C\CC1=C(C)C(OC(=O)[C@@H]2[C@@H](/C=C(\C)C(=O)OC)C2(C)C)CC1=O

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Identifiers

InChI

InChI=1S/C22H28O5/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6/h7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8-,13-11+/t16-,18?,19+/m1/s1

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InChIKey

VJFUPGQZSXIULQ-IAQGAHJNSA-N

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1 reference

26 December 2021

1 reference

(Q104376070)

[2-Methyl-4-oxo-3-[(2Z)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate

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