Structure Information
Structure

Compound Identification

SMILES

COC1=CC(OCC2=CC=CC=C2)=C(C=C1)C1(OC)C(OC(C)=O)OC2=C(C=CC(OCC3=CC=CC=C3)=C2)C1=O

InChIKey

InChIKey=LXPXFIRBNHJDRF-UHFFFAOYSA-N

Formula

C33H30O8

Mass

554.595

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

O-methylated isoflavonoids

Intermediate Tree Nodes

Not available

Direct Parent

4'-O-methylated isoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-methoxyisoflavonoid-skeleton - 4p-methoxyisoflavonoid - Isoflavanone - Isoflavan - Chromone - Chromane - Benzopyran - 1-benzopyran - Benzylether - Aryl ketone - Methoxybenzene - Phenol ether - Aryl alkyl ketone - Anisole - Phenoxy compound - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Ketone - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Oxacycle - Acetal - Monocarboxylic acid or derivatives - Dialkyl ether - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 4'-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C4' atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.

External Descriptors

Not available

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