Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=CC(NC(N)=NC(=O)\C=C\C2=CC=CO2)=C1)C1=CC2=CC=CC=C2OC1=O

InChIKey

InChIKey=IPBYGSPYWNJNSO-PKNBQFBNSA-N

Formula

C24H19N3O5

Mass

429.432

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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 - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Acylguanidine - Alkyl aryl ether - Pyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Furan - N-acylimine - Lactone - Guanidine - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Oxacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Ether - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organopnictogen 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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