Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC(OC)=C1O)C1=[O+]C2=CC(O)=CC(O[C@@H]3OC(CO)[C@@H](O)C(O)C3O)=C2C=C1O[C@@H]1OC(COC(=O)\C=C/C2=CC=C(O)C=C2)[C@@H](O)C(O)C1O

InChIKey

InChIKey=KGEHZUCHEKVXEU-VSBRXGEJSA-O

Formula

C38H41O19

Mass

801.726

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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-p-coumaroyl glycosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flavonoid 3-o-6-p-coumaroyl-glycoside - Anthocyanidin-5-o-glycoside - Anthocyanin - Anthocyanidin-3-o-glycoside - Flavonoid-3-o-glycoside - 3p-methoxyflavonoid-skeleton - 7-hydroxyflavonoid - Hydroxyflavonoid - 4'-hydroxyflavonoid - Anthocyanidin - Phenolic glycoside - Coumaric acid ester - Coumaric acid or derivatives - Cinnamic acid ester - Hydroxycinnamic acid or derivatives - Cinnamic acid or derivatives - Glycosyl compound - O-glycosyl compound - M-dimethoxybenzene - Dimethoxybenzene - Methoxyphenol - Benzopyran - 1-benzopyran - Methoxybenzene - Styrene - Phenoxy compound - Phenol ether - Anisole - Alkyl aryl ether - Fatty acid ester - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Fatty acyl - Monosaccharide - Benzenoid - Oxane - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Polyol - Acetal - Organoheterocyclic compound - Oxacycle - Organic oxygen compound - Organic oxide - Carbonyl group - Organooxygen compound - Primary alcohol - Alcohol - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavonoid 3-o-p-coumaroyl glycosides. These are flavonoid 3-O-glycosides where the carbohydrate moiety is esterified with a p-coumaric acid. P-coumaric acid is an organic derivative of cinnamic acid, that carries a hydroxyl group at the 4-position of the benzene ring.

External Descriptors

Not available

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