Structure Information
Structure

Compound Identification

SMILES

CC1=C(NC(=O)C2=CC=CC(=C2)C2=CC3=CC=CC=C3OC2=O)C=C(C=C1)C1=NC2=C(O1)C=CC=N2

InChIKey

InChIKey=VQZORYUBRVLFGI-UHFFFAOYSA-N

Formula

C29H19N3O4

Mass

473.488

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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 - Benzanilide - Aromatic anilide - Coumarin - Phenyl-1,3-oxazole - 1-benzopyran - Benzopyran - Benzamide - 1,3-oxazolopyridine - Benzoic acid or derivatives - Benzoyl - Toluene - Pyranone - Monocyclic benzene moiety - Benzenoid - Pyridine - Pyran - Heteroaromatic compound - Oxazole - Azole - Carboxamide group - Lactone - Secondary carboxylic acid amide - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organopnictogen compound - Organooxygen compound - 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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