Structure Information
Structure

Compound Identification

SMILES

COC1=CC2=C(C=C1)C(C1=CC3=C(OCC(=O)N3)C=C1)=C(C1=CC=CC=C1)C(C)(C)O2

InChIKey

InChIKey=KREUGRLQRHURCN-UHFFFAOYSA-N

Formula

C26H23NO4

Mass

413.473

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

O-methylated isoflavonoids

Intermediate Tree Nodes

Not available

Direct Parent

7-O-methylated isoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

7-methoxyisoflavonoid-skeleton - Isoflav-3-ene skeleton - Precocene - Stilbene - 2,2-dimethyl-1-benzopyran - Benzoxazinone - Benzomorpholine - Benzopyran - Benzoxazine - 1-benzopyran - Anisole - Alkyl aryl ether - Monocyclic benzene moiety - Oxazinane - Benzenoid - Lactam - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic oxide - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 7-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C7 atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.

External Descriptors

Not available

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