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Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC=C1C1=CC(=O)C2=C(O)C(O)=C(O[C@@]3(O)O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)C=C2O1

InChIKey

InChIKey=QTLAUFZCVPGLMP-YIUJWAEMSA-N

Formula

C22H20O13

Mass

492.389

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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 - 2p-methoxyflavonoid-skeleton - Flavone - 5-hydroxyflavonoid - 6-hydroxyflavonoid - Hydroxyflavonoid - Phenolic glycoside - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Chromone - Benzopyran - 1-benzopyran - Phenoxy compound - Methoxybenzene - Anisole - Phenol ether - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Beta-hydroxy acid - Alkyl aryl ether - Pyranone - Monocyclic benzene moiety - Hydroxy acid - Oxane - Monosaccharide - Pyran - Benzenoid - Vinylogous acid - Heteroaromatic compound - Orthocarboxylic acid derivative - Secondary alcohol - Oxacycle - Organoheterocyclic compound - Polyol - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Ether - Hydrocarbon derivative - Organooxygen compound - Alcohol - Carbonyl group - Organic oxygen compound - 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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