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Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC(CC2=CC=CC=C2)=C\C(=C/NC2=CC=C(C=C2)C2=CC3=CC=CC=C3OC2=O)C1=O

InChIKey

InChIKey=AHVMUKHQAYTQPF-PTGBLXJZSA-N

Formula

C29H20N2O5

Mass

476.488

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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 - Coumarin - Benzopyran - 1-benzopyran - O-quinomethane - Quinomethane - Aniline or substituted anilines - Pyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Vinylogous amide - Organic nitro compound - Ketone - Lactone - C-nitro compound - Cyclic ketone - Allylamine - Oxacycle - Enamine - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Aldehyde - Organic nitrogen compound - Organic salt - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Amine - Organopnictogen compound - Organic oxide - Organic zwitterion - 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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