Structure Information
Structure

Compound Identification

SMILES

CC1O[C@@H](OCC2O[C@@H](OC3=C([O+]=C4C=C(O)C=C(O[C@@H]5OC(CO)[C@@H](O)[C@H](O)C5O)C4=C3)C3=CC(O)=C(O)C=C3)C(O)C(O)[C@@H]2O)C(O)[C@@H](O)[C@H]1OC(=O)\C=C\C1=CC(O)=C(O)C=C1

InChIKey

InChIKey=ZKKZXJHFKFTOPC-QGMOHJAQSA-O

Formula

C42H47O23

Mass

919.814

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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 - Anthocyanins

Direct Parent

Anthocyanidin-5-O-glycosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Anthocyanidin-3-o-glycoside - Anthocyanidin-5-o-glycoside - Flavonoid-3-o-glycoside - 3'-hydroxyflavonoid - 4'-hydroxyflavonoid - 7-hydroxyflavonoid - Hydroxyflavonoid - Anthocyanidin - Phenolic glycoside - Cinnamic acid or derivatives - Coumaric acid or derivatives - Hydroxycinnamic acid or derivatives - Cinnamic acid ester - Disaccharide - Glycosyl compound - O-glycosyl compound - Benzopyran - 1-benzopyran - Catechol - Styrene - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Fatty acid ester - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Oxane - Benzenoid - Fatty acyl - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Secondary alcohol - Carboxylic acid ester - Acetal - Oxacycle - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Primary alcohol - Organic oxygen compound - Carbonyl group - Alcohol - Organooxygen compound - Organic oxide - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as anthocyanidin-5-o-glycosides. These are phenolic compounds containing one anthocyanidin moiety which is O-glycosidically linked to a carbohydrate moiety at the C5-position.

External Descriptors

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