Structure Information
Structure

Compound Identification

SMILES

O[C@H]1[C@H](O)[C@@H](Oc2cc(O)c3C(=O)C[C@@H](Oc3c2)c2ccc(O)c(O)c2)O[C@H]([C@@H]1O)C(O)=O

InChIKey

InChIKey=YSORAXGDTRAEMV-YBTGAFFXSA-N

Formula

C21H20O12

Mass

464.379

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

Flavonoid glycosides

Intermediate Tree Nodes

Flavonoid O-glycosides - Flavonoid O-glucuronides

Direct Parent

Flavonoid-7-O-glucuronides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flavonoid-7-o-glucuronide - Flavonoid-7-o-glycoside - Hydroxyflavonoid - Flavanone - 5-hydroxyflavonoid - 4'-hydroxyflavonoid - 3'-hydroxyflavonoid - Flavan - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - Phenolic glycoside - O-glucuronide - 1-o-glucuronide - Glucuronic acid or derivatives - Alkyl glycoside - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Chromone - 1-benzopyran - Chromane - Benzopyran - Catechol - Aryl ketone - Aryl alkyl ketone - 1-hydroxy-2-unsubstituted benzenoid - Beta-hydroxy acid - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Pyran - Monocyclic benzene moiety - Monosaccharide - Hydroxy acid - Benzenoid - Fatty acyl - Oxane - Vinylogous acid - Secondary alcohol - Ketone - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Polyol - Organoheterocyclic compound - Oxacycle - Acetal - Ether - Carbonyl group - Organooxygen compound - Organic oxygen compound - Aldehyde - Alcohol - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavonoid-7-o-glucuronides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid at the C7-position.

External Descriptors

Not available

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