Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(C)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CO2)C1=CC=CC=C1

InChIKey

InChIKey=PUQRIBKJBZOSOK-UHFFFAOYSA-N

Formula

C21H19NO6

Mass

381.384

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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 - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alanine or derivatives - Chromone - Alpha-amino acid or derivatives - Benzopyran - 1-benzopyran - Alkyl aryl ether - Pyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - 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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