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Structure Information
Structure

Compound Identification

SMILES

CC1=C(C(=O)C2=C(O1)C=C(OC(=O)C1=CC=CC(=C1)C#N)C=C2)C1=CC=CC=C1

InChIKey

InChIKey=KRGXALJAIZIKNR-UHFFFAOYSA-N

Formula

C24H15NO4

Mass

381.387

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

Isoflav-2-enes

Intermediate Tree Nodes

Not available

Direct Parent

Isoflavones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoflavone - Chromone - Benzoate ester - Benzopyran - 1-benzopyran - Phenol ester - Benzoic acid or derivatives - Benzonitrile - Benzoyl - Pyranone - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Carbonitrile - Nitrile - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Cyanide - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon atom.

External Descriptors

Not available

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