Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC(\C=C\C(=O)C2=CC=C(C=C2)N2C(SCC2=O)C2=CC3=C(OCO3)C=C2)=C1

InChIKey

InChIKey=BYJVWSHNMUCJLW-ONNFQVAWSA-N

Formula

C25H18ClNO4S

Mass

463.93

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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 heteropolycyclic compounds

Substituents

Retrochalcone - Cinnamic acid or derivatives - Benzodioxole - Benzoyl - Styrene - Aryl ketone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Enone - Tertiary carboxylic acid amide - Alpha,beta-unsaturated ketone - Thiazolidine - Ketone - Lactam - Carboxamide group - Carboxylic acid derivative - Thioether - Dialkylthioether - Organoheterocyclic compound - Azacycle - Oxacycle - Acetal - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Aldehyde - Organic oxygen compound - Aromatic heteropolycyclic 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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