Structure Information
Structure

Compound Identification

SMILES

COC1=CC2=C(C(=O)C(=CO2)C2=CC=C(O)C=C2O)C(OS(O)(=O)=O)=C1CC=C(C)C

InChIKey

InChIKey=WXBNPBUKHAELSA-UHFFFAOYSA-N

Formula

C21H20O9S

Mass

448.44

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

Isoflavans

Intermediate Tree Nodes

Isoflavanones

Direct Parent

6-prenylated isoflavanones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

6-prenylated isoflavanone - 7-o-methylisoflavone - Isoflavone - Hydroxyisoflavonoid - Chromone - 1-benzopyran - Arylsulfate - Benzopyran - Resorcinol - Anisole - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Pyranone - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Sulfuric acid ester - Sulfate-ester - Sulfuric acid monoester - Pyran - Monocyclic benzene moiety - Organic sulfuric acid or derivatives - Heteroaromatic compound - Oxacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 6-prenylated isoflavanones. These are isoflavanones featuring a C5-isoprenoid unit at the 6-position.

External Descriptors

Not available

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