Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C2=C(OC=C(C2)C2=CC=CC=C2OC(=O)C2=CN=CC=C2)C=C1

InChIKey

InChIKey=ZHYDYUWELAOQAN-UHFFFAOYSA-N

Formula

C23H19NO5

Mass

389.407

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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

6-O-methylated isoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5-methoxyisoflavonoid-skeleton - 6-methoxyisoflavonoid-skeleton - Isoflav-2-ene skeleton - Phenol ester - 1-benzopyran - Benzopyran - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Phenoxy compound - Phenol ether - Anisole - Alkyl aryl ether - Pyridine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Carboxylic acid ester - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 6-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C6 atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.

External Descriptors

Not available

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