Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C1=CC=C(OCC(=O)NC2=CC=CC3=C2C=CN3)C=C1

InChIKey

InChIKey=ACIUNDICORWNQS-UHFFFAOYSA-N

Formula

C26H20N2O5

Mass

440.455

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

Isoflav-3-enes

Intermediate Tree Nodes

Not available

Direct Parent

Isoflav-3-enones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoflav-3-enone skeleton - Coumarin - Benzopyran - 1-benzopyran - Indole - Indole or derivatives - Anisole - Phenoxy compound - Phenol ether - N-arylamide - Pyranone - Alkyl aryl ether - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Pyrrole - Secondary carboxylic acid amide - Lactone - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organooxygen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoflav-3-enones. These are flavonoids with a structure based on an isoflav-3-ene skeleton bearing an oxo-group at position C2.

External Descriptors

Not available

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