Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C1=C(OC2=C(C=CC(OC3=CC=CC=C3)=C2)C1=O)SC1=CC=C(O)C=C1

InChIKey

InChIKey=ULQLXVXJVOHDIU-UHFFFAOYSA-N

Formula

C28H20O5S

Mass

468.52

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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

4'-O-methylisoflavones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4p-o-methylisoflavone - Isoflavone - Diaryl ether - Chromone - Diarylthioether - 1-benzopyran - Benzopyran - Methoxybenzene - Phenol ether - Phenoxy compound - Aryl thioether - Thiophenol ether - Anisole - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - Phenol - Monocyclic benzene moiety - Vinylogous thioester - Benzenoid - Pyran - Heteroaromatic compound - Oxacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Ether - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 4'-o-methylisoflavones. These are isoflavones with methoxy groups attached to the C4' atom of the isoflavone backbone.

External Descriptors

Not available

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