Structure Information
Structure

Compound Identification

SMILES

COC(=O)C([O-])=CC(=O)CCC1=CC=CC=C1

InChIKey

InChIKey=JHTUYTJVAMSEKY-UHFFFAOYSA-M

Formula

C13H13O4

Mass

233.244

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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

Not available

Direct Parent

Fatty acid esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Fatty acid ester - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Enone - Vinylogous acid - Alpha,beta-unsaturated ketone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Ketone - Enolate - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organic anion - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.

External Descriptors

Not available

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