Structure Information
Structure

Compound Identification

SMILES

COC1=CC(\C=C\C(=O)OCC2O[C@@H](OC3[C@H](OC4[C@H](OC5=C(OC6=CC(O)=CC(O)=C6C5=O)C5=CC(O)=C(O)C=C5)OC(CO)[C@@H](O)[C@@H]4O)OC(CO)[C@H](O)C3O)[C@H](O)C(O)[C@@H]2O)=CC(OC)=C1O

InChIKey

InChIKey=XGPMZWIBBAEMRZ-AVZCLPJBSA-N

Formula

C44H50O26

Mass

994.858

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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-3-O-glycosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Oligosaccharide - Flavonoid-3-o-glycoside - 3'-hydroxyflavonoid - 4'-hydroxyflavonoid - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Flavone - Hydroxyflavonoid - Hydroxycinnamic acid or derivatives - Cinnamic acid ester - Coumaric acid or derivatives - Cinnamic acid or derivatives - O-glycosyl compound - Glycosyl compound - Chromone - Methoxyphenol - M-dimethoxybenzene - 1-benzopyran - Dimethoxybenzene - Benzopyran - Styrene - Phenol ether - Methoxybenzene - Anisole - Phenoxy compound - Catechol - Phenol - Pyranone - Fatty acid ester - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Pyran - Oxane - Heteroaromatic compound - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous acid - Secondary alcohol - Carboxylic acid ester - Ether - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Acetal - Organoheterocyclic compound - Polyol - Oxacycle - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Primary alcohol - Organic oxide - Carbonyl group - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position.

External Descriptors

LIPIDMAPS (LMPK12112154) : Flavones and Flavonols

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