Structure Information
Structure

Compound Identification

SMILES

OCC1O[C@@H](OC2=CC3=[O+]C(=C(O[C@@H]4OC(COC(=O)CC(O)=O)[C@@H](O)[C@H](O)C4O)C=C3C(O)=C2)C2=CC=C(O)C=C2)C(O)[C@@H](O)[C@@H]1O

InChIKey

InChIKey=FWXROQWVMFXBGG-BENQLBHSSA-O

Formula

C30H33O18

Mass

681.575

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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-7-O-Glycosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Anthocyanidin-3-o-glycoside - Anthocyanidin-7-o-glycoside - Flavonoid-7-o-glycoside - Flavonoid-3-o-glycoside - 4'-hydroxyflavonoid - 5-hydroxyflavonoid - Hydroxyflavonoid - Anthocyanidin - Phenolic glycoside - Glycosyl compound - O-glycosyl compound - Benzopyran - 1-benzopyran - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Monosaccharide - 1,3-dicarbonyl compound - Oxane - Heteroaromatic compound - Secondary alcohol - Carboxylic acid ester - Polyol - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Acetal - Carboxylic acid - Organic oxygen compound - Primary alcohol - Alcohol - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as anthocyanidin-7-o-glycosides. These are phenolic compounds containing one anthocyanidin moiety which is O-glycosidically linked to a carbohydrate moiety at the C7-position.

External Descriptors

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