Structure Information
Structure

Compound Identification

SMILES

CCCCC1=CC=C(C=C1)N1N=C2C=C(Cl)C(NC(=O)C3=CC=CC(=C3)C3=CC4=CC=CC=C4OC3=O)=CC2=N1

InChIKey

InChIKey=OYLIFVCYBXPPAH-UHFFFAOYSA-N

Formula

C32H25ClN4O3

Mass

549.03

Export to:

JSON SDF CSV

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 - Phenyltriazole - Phenyl-1,2,3-triazole - Benzopyran - 1-benzopyran - Benzamide - Benzoic acid or derivatives - Benzotriazole - Benzoyl - Pyranone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyran - Benzenoid - Azole - 1,2,3-triazole - Triazole - Heteroaromatic compound - Secondary carboxylic acid amide - Lactone - Carboxamide group - Azacycle - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen 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

Previous Back Next