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Structure Information
Structure

Compound Identification

SMILES

O[C@H]1[C@H](O)[C@H](OC(O)(OC2=CC3=C(C=C2)C(=O)C=C(O3)C2=CC=C(O)C=C2)[C@@H]1O)C(O)=O

InChIKey

InChIKey=WDFVQZRZEDFRNJ-MCXOOUIESA-N

Formula

C21H18O11

Mass

446.364

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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 - 4'-hydroxyflavonoid - Flavone - Hydroxyflavonoid - Monohydroxyflavonoid - Phenolic glycoside - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Chromone - Benzopyran - 1-benzopyran - Phenol ether - Beta-hydroxy acid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyranone - Oxane - Monosaccharide - Monocyclic benzene moiety - Hydroxy acid - Pyran - Benzenoid - Heteroaromatic compound - Orthocarboxylic acid derivative - Secondary alcohol - Oxacycle - Monocarboxylic acid or derivatives - Polyol - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Carbonyl group - Organic oxide - Alcohol - Organic oxygen compound - Hydrocarbon derivative - 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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