Structure Information
Structure

Compound Identification

SMILES

OC(=O)CCC(=O)C=CC1=CC=CC=C1O

InChIKey

InChIKey=KNQJRDJKWMXBKG-UHFFFAOYSA-N

Formula

C12H12O4

Mass

220.224

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Hydroxycinnamic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Hydroxycinnamic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Hydroxycinnamic acid or derivatives - Medium-chain keto acid - Gamma-keto acid - Styrene - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Hydroxy fatty acid - Phenol - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Unsaturated fatty acid - Keto acid - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Ketone - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as hydroxycinnamic acids and derivatives. These are compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated.

External Descriptors

Not available

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