Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=C(\C=C2/CC3=CC4=C(C\C(=C/C5=CC=C(Cl)C=C5)C(=O)O4)C=C3OC2=O)C=C1

InChIKey

InChIKey=VNBQKZHYPCTDOR-LQGKIZFRSA-N

Formula

C26H16Cl2O4

Mass

463.31

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Homoisoflavonoids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Homoisoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Homoisoflavonoid - Pyranocoumarin - Linear pyranocoumarin - Pyranochromene - 3,4-dihydrocoumarin - Benzopyran - Chromane - 1-benzopyran - Chlorobenzene - Halobenzene - Monocyclic benzene moiety - Benzenoid - Aryl halide - Dicarboxylic acid or derivatives - Aryl chloride - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Lactone - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as homoisoflavonoids. These are naturally occurring oxygen heterocycles with a structure based on a 16-carbon skeleton including a chromanone, chromone or chromane system with a benzyl group at position C-3.

External Descriptors

Not available

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