Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(C)=C[C@H]1[C@@H](C(=O)O[C@H]2CC(=O)C(CC=C[C@H](O)CO)=C2C)C1(C)C

InChIKey

InChIKey=IGFVRTQBLONSMV-CBVHJVASSA-N

Formula

C22H30O7

Mass

406.475

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acid esters

Intermediate Tree Nodes

Pyrethroids

Direct Parent

Pyrethrins

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

Pyrethrin-backbone - Monocyclic monoterpenoid - Monoterpenoid - Carbocyclic fatty acid - Fatty alcohol - Hydroxy fatty acid - Cyclopropanecarboxylic acid or derivatives - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Cyclic ketone - Ketone - 1,2-diol - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Alcohol - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organooxygen compound - Primary alcohol - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrethrins. These are pyrethroids with a structure based on a skeleton that is characterized by the presence of a chrysanthemic acid esterified with a cyclopentenone derivative.

External Descriptors

Not available

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