Structure Information
Structure

Compound Identification

SMILES

COC1=C(OCC([O-])=O)C=CC(\C=C\C(=O)C2=CC(Cl)=CC=C2)=C1

InChIKey

InChIKey=MWEZEKNZKREBOB-FNORWQNLSA-M

Formula

C18H14ClO5

Mass

345.76

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Chalcones and dihydrochalcones

Intermediate Tree Nodes

Not available

Direct Parent

Retrochalcones

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Retrochalcone - Cinnamic acid or derivatives - Phenoxyacetate - Phenoxy compound - Benzoyl - Phenol ether - Styrene - Aryl ketone - Methoxybenzene - Anisole - Chlorobenzene - Alkyl aryl ether - Halobenzene - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Carboxylic acid salt - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Ether - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic anion - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.

External Descriptors

Not available

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