Structure Information
Structure

Compound Identification

SMILES

CC1=C[N+](=CC=C1)C1=C(O)C=CC(O)=C1C1=C([O-])OC2=CC=CC=C2C1=O

InChIKey

InChIKey=KXERONTXRNQHKI-UHFFFAOYSA-N

Formula

C21H15NO5

Mass

361.353

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

Isoflav-2-enes

Intermediate Tree Nodes

Not available

Direct Parent

Isoflavones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoflavone - Hydroxyisoflavonoid - Chromone - Coumarin - 1-benzopyran - Benzopyran - Hydroquinone - Phenol - Pyranone - 1-hydroxy-2-unsubstituted benzenoid - Methylpyridine - Pyridine - Benzenoid - Pyran - Monocyclic benzene moiety - Pyridinium - Vinylogous acid - Heteroaromatic compound - Organoheterocyclic compound - Azacycle - Oxacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon atom.

External Descriptors

Not available

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