Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(\C=C\C(=O)C2=CC=C(OC3=C4C=CC(Cl)=CC4=NC=C3)C=C2)C=C1

InChIKey

InChIKey=WQSJQWTVZHMDRW-YIXHJXPBSA-N

Formula

C25H18ClNO3

Mass

415.87

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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 - Diaryl ether - Haloquinoline - Chloroquinoline - Quinoline - Anisole - Benzoyl - Phenoxy compound - Phenol ether - Styrene - Aryl ketone - Methoxybenzene - Alkyl aryl ether - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Pyridine - Aryl halide - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Acryloyl-group - Enone - Ketone - Azacycle - Organoheterocyclic compound - Ether - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen compound - 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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