Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=CC2=C1OCO2)C1=CC2=CC3=C(OC(C)(C)C=C3)C=C2OC1=O

InChIKey

InChIKey=TXZAKQXZHMDDJE-UHFFFAOYSA-N

Formula

C22H18O6

Mass

378.38

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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 - Linear pyranocoumarin - Pyranocoumarin - Pyranochromene - 2,2-dimethyl-1-benzopyran - Coumarin - Benzopyran - 1-benzopyran - Benzodioxole - Anisole - Alkyl aryl ether - Pyranone - Benzenoid - Pyran - Heteroaromatic compound - Lactone - Organoheterocyclic compound - Ether - Oxacycle - Acetal - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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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