Structure Information
Structure

Compound Identification

SMILES

OC1C(O)[C@H](OC2=C(O[C@@H]3OC([C@H](O)[C@H](O)C3O)C(O)=O)C=C(C=C2)C2=CC(=O)C3=C(O)C=C(O)C=C3O2)OC([C@@H]1O)C(O)=O

InChIKey

InChIKey=ICPYZSUYRCEHSC-UMOQLKIHSA-N

Formula

C27H26O18

Mass

638.487

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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

Direct Parent

Flavonoid O-glucuronides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flavonoid-3p-o-glucuronide - Flavonoid-4p-o-glucuronide - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Flavone - Hydroxyflavonoid - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - Phenolic glycoside - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Alkyl glycoside - Chromone - Glycosyl compound - O-glycosyl compound - 1-benzopyran - Benzopyran - Phenol ether - Phenoxy compound - Pyranone - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Beta-hydroxy acid - Oxane - Pyran - Benzenoid - Monocyclic benzene moiety - Monosaccharide - Hydroxy acid - Fatty acyl - Dicarboxylic acid or derivatives - Vinylogous acid - Heteroaromatic compound - Secondary alcohol - Carboxylic acid - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Polyol - Acetal - Hydrocarbon derivative - Carbonyl group - Alcohol - Organooxygen compound - Organic oxygen compound - Organic oxide - 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

LIPIDMAPS (LMPK12110677) : Flavones and Flavonols

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