Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1O[C@@H](OC[C@@H]2O[C@H](OC3=C([O+]=C4C=C(O)C=C(O[C@@H]5O[C@@H](O)[C@H](O[C@@H]6O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]6CO)[C@@H](O)[C@@H]5CO)C4=C3)C3=CC=C(O)C=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1OC(=O)\C=C\C1=CC=C(O)C=C1

InChIKey

InChIKey=OEICSUATTPDILC-GRTFFAHBSA-O

Formula

C48H57O26

Mass

1049.957

Export to:

JSON SDF CSV

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

Not available

Previous Back Next