Structure Information
Structure

Compound Identification

SMILES

OCC1O[C@@H](OC2=C(O)C=CC(=C2)C2=CC(=O)C3=C(O)C=C(O[C@@H]4OC([C@@H](O)[C@H](O)C4O)C(O)=O)C=C3O2)C(O)[C@@H](O)[C@@H]1O

InChIKey

InChIKey=RISDMLSLRAZUPQ-ZXJFBCABSA-N

Formula

C27H28O17

Mass

624.504

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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 - 4'-hydroxyflavonoid - 5-hydroxyflavonoid - Flavone - Phenolic glycoside - O-glucuronide - 1-o-glucuronide - Glucuronic acid or derivatives - Glycosyl compound - O-glycosyl compound - Chromone - Benzopyran - 1-benzopyran - Phenoxy compound - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Pyranone - Beta-hydroxy acid - Monocyclic benzene moiety - Benzenoid - Hydroxy acid - Monosaccharide - Pyran - Oxane - Heteroaromatic compound - Vinylogous acid - Secondary alcohol - Polyol - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Acetal - Organooxygen compound - Carbonyl group - Organic oxygen compound - Primary alcohol - 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

LIPIDMAPS (LMPK12110666) : Flavones and Flavonols

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