Structure Information
Structure

Compound Identification

SMILES

CCC=CC[C@H]1[C@@H](CC([O-])=O)CCC1=O

InChIKey

InChIKey=ZNJFBWYDHIGLCU-ZJUUUORDSA-M

Formula

C12H17O3

Mass

209.266

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Lineolic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Jasmonic acids

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

Jasmonic acid - Cyclic ketone - Ketone - Carboxylic acid salt - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic anion - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as jasmonic acids. These are lipids containing or derived from a jasmonic acid, with a structure characterized by the presence of an alkene chain linked to a 2-(3-oxocyclopentyl)acetic acid moiety.

External Descriptors

Not available

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