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Structure Information
Structure

Compound Identification

SMILES

COC1OC2=C(C=CC(OS(=O)(=O)C3=CC=C(C)C=C3)=C2)C(=O)C1(OC(C)=O)C1=C(OS(=O)(=O)C2=CC=C(C)C=C2)C=C(OC)C=C1

InChIKey

InChIKey=JKGWQJBNJOQVJL-UHFFFAOYSA-N

Formula

C33H30O12S2

Mass

682.71

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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

2-methoxyisoflavonoid-skeleton - 4p-methoxyisoflavonoid - Isoflavanone - Isoflavan - Benzenesulfonate ester - Chromone - P-methylbenzenesulfonate - Chromane - Benzopyran - Benzyloxycarbonyl - Benzenesulfonate - Tosyl compound - 1-benzopyran - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Phenoxy compound - Anisole - Methoxybenzene - Aryl alkyl ketone - Phenol ether - Aryl ketone - Toluene - Alkyl aryl ether - Alpha-acyloxy ketone - Benzenoid - Organosulfonic acid ester - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Ether - Organoheterocyclic compound - Oxacycle - Acetal - Carboxylic acid derivative - Organic oxide - Organosulfur compound - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Carbonyl group - 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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