Structure Information
Structure

Compound Identification

SMILES

O[C@H]1[C@H](O)[C@@H](OC2=C(O)C=CC(=C2)C2=C(OS(O)(=O)=O)C(=O)C3=CC=CC=C3O2)O[C@H]([C@@H]1O)C(O)=O

InChIKey

InChIKey=WMYNSQXLIUQKAK-BJQFSTQPSA-N

Formula

C21H18O14S

Mass

526.42

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

Flavonoid glycosides

Intermediate Tree Nodes

Flavonoid O-glycosides

Direct Parent

Flavonoid O-glucuronides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flavonoid-3p-o-glucuronide - 3-sulfated flavonoid - 4'-hydroxyflavonoid - Monohydroxyflavonoid - Hydroxyflavonoid - Flavone - Phenolic glycoside - O-glucuronide - 1-o-glucuronide - Glucuronic acid or derivatives - Glycosyl compound - O-glycosyl compound - Chromone - 1-benzopyran - Arylsulfate - Benzopyran - Phenol ether - Phenoxy compound - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - Beta-hydroxy acid - Monocyclic benzene moiety - Benzenoid - Sulfuric acid ester - Hydroxy acid - Sulfate-ester - Sulfuric acid monoester - Monosaccharide - Pyran - Oxane - Organic sulfuric acid or derivatives - Heteroaromatic compound - Secondary alcohol - Carboxylic acid derivative - Polyol - Monocarboxylic acid or derivatives - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Acetal - Organic oxide - Organic oxygen compound - Organooxygen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavonoid o-glucuronides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid.

External Descriptors

Not available

Previous Back Next