Structure Information
Structure

Compound Identification

SMILES

CC1O[C@@H](OC2C(O)C3=C(O)C=C(O)C=C3OC2C2=CC(O)=C(O)C(O)=C2)[C@@H](O)C(O)[C@H]1O[C@@H]1OC(CO)[C@@H](O)C(O)C1O

InChIKey

InChIKey=LTQCWUJVAPKOBF-JQGVDKNXSA-N

Formula

C27H34O17

Mass

630.552

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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

Epigallocatechin - Flavonoid-3-o-glycoside - Catechin - Leucoanthocyanidin-skeleton - Hydroxyflavonoid - 3'-hydroxyflavonoid - 4'-hydroxyflavonoid - 7-hydroxyflavonoid - 5-hydroxyflavonoid - 4-hydroxyflavonoid - Flavan - Disaccharide - O-glycosyl compound - Glycosyl compound - Chromane - Benzopyran - 1-benzopyran - Pyrogallol derivative - Benzenetriol - Phenol - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Monocyclic benzene moiety - Oxane - Secondary alcohol - Polyol - Acetal - Organoheterocyclic compound - Oxacycle - Ether - Primary alcohol - Hydrocarbon derivative - Alcohol - Organic oxygen compound - 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 (LMPK12020207) : Flavans, Flavanols and Leucoanthocyanidins

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