Structure Information
Structure

Compound Identification

SMILES

CO[C@@H]1OC2=C(C=C(OS(=O)(=O)C3=CC=C(C)C=C3)C=C2)[C@@H](OC)[C@H]1C1=CC=CC=C1

InChIKey

InChIKey=PLAQZQGKGPFNIH-WXFUMESZSA-N

Formula

C24H24O6S

Mass

440.51

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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 - 4-methoxyisoflavonoid-skeleton - Isoflavan - Benzenesulfonate ester - P-methylbenzenesulfonate - Chromane - Benzopyran - 1-benzopyran - Tosyl compound - Benzenesulfonate - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Toluene - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid ester - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Ether - Dialkyl ether - Organoheterocyclic compound - Oxacycle - Acetal - Organosulfur compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - 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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