Structure Information
Structure

Compound Identification

SMILES

OC1C(COC(=O)CC(O)=O)OC(Oc2cc3c(cc(O)cc3=O)oc2-c2cc(OC3OC(COC(=O)C=Cc4ccc(O)cc4)C(O)C(O)C3O)c(O)c(OC3OC(C[O]=C(O)C=Cc4ccc(O)cc4)C(O)C(O)C3O)c2)C(O)C1O

InChIKey

InChIKey=GOUVYIIMFSEQMA-UHFFFAOYSA-N

Formula

C54H55O29

Mass

1168.005

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

Direct Parent

Flavonoid 3p-O-p-coumaroyl glycosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flavonoid 3p-o-6-p-coumaroyl-glycoside - Flavonoid-3-o-glycoside - Hydroxyflavonoid - 4'-hydroxyflavonoid - 7-hydroxyflavonoid - Phenolic glycoside - Tetracarboxylic acid or derivatives - Coumaric acid ester - Hydroxycinnamic acid or derivatives - Cinnamic acid ester - Hydroxycinnamic acid - Cinnamic acid - Coumaric acid or derivatives - Coumaric acid - Cinnamic acid or derivatives - O-glycosyl compound - Glycosyl compound - Benzopyran - 1-benzopyran - Phenoxy compound - Styrene - Phenol ether - Phenol - Fatty acid ester - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Fatty acyl - Benzenoid - 1,3-dicarbonyl compound - Monosaccharide - Oxane - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous acid - Heteroaromatic compound - Secondary alcohol - Carboxylic acid ester - Polyol - Acetal - Carboximidic acid - Carboxylic acid derivative - Organoheterocyclic compound - Carboxylic acid - Oxacycle - Carbonyl group - Organic oxygen compound - Organooxygen compound - Alcohol - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavonoid 3p-o-p-coumaroyl glycosides. These are flavonoid 3p-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

Previous Back Next