Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=C([C@@H]2COC3=C(C=CC(O)=C3)C2=O)C(O)=C1O)C(C)(C)C=C

InChIKey

InChIKey=KNQQUXVBDOWOCQ-AWEZNQCLSA-N

Formula

C21H22O6

Mass

370.401

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

O-methylated isoflavonoids

Intermediate Tree Nodes

4'-O-methylated isoflavonoids

Direct Parent

3'-hydroxy,4'-methoxyisoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3'-hydroxy,4'-methoxyisoflavonoid - Hydroxyisoflavonoid - Isoflavanol - Isoflavanone - Isoflavan - Chromone - Methoxyphenol - Chromane - Benzopyran - 1-benzopyran - Phenylpropane - Aryl ketone - Aryl alkyl ketone - Methoxybenzene - Catechol - Anisole - Phenoxy compound - Phenol ether - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Benzenoid - Monocyclic benzene moiety - Ketone - Organoheterocyclic compound - Oxacycle - Ether - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3'-hydroxy,4'-methoxyisoflavonoids. These are isoflavonoids carrying a methoxy group attached to the C4' atom, as well as a hydroxyl group at the C3'-position of the isoflavonoid backbone.

External Descriptors

Not available

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