Structure Information
Structure

Compound Identification

SMILES

COC1=C(O)C=CC(\C=C\C(=O)OC2[C@H](OCC3O[C@@H](OC4=C(OC5=CC(O)=C(OC)C(O)=C5C4=O)C4=CC(O)=C(O)C=C4)C(O[C@@H]4OCC(O)(CO)[C@@H]4O)[C@@H](O)[C@@H]3O)OC(CO)[C@@H](O)[C@@H]2O)=C1

InChIKey

InChIKey=VSMDAOFJZBLZOB-JPWWWHFLSA-N

Formula

C43H48O25

Mass

964.832

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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-glycosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Oligosaccharide - Flavonoid-3-o-glycoside - 6-methoxyflavonoid-skeleton - 3'-hydroxyflavonoid - 4'-hydroxyflavonoid - 5-hydroxyflavonoid - Flavone - 7-hydroxyflavonoid - Hydroxyflavonoid - Cinnamic acid or derivatives - Coumaric acid or derivatives - Hydroxycinnamic acid or derivatives - Cinnamic acid ester - Chromone - Glycosyl compound - O-glycosyl compound - Methoxyphenol - Benzopyran - 1-benzopyran - Styrene - Anisole - Phenol ether - Catechol - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - Phenol - Fatty acid ester - 1-hydroxy-4-unsubstituted benzenoid - Pyran - Oxane - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Heteroaromatic compound - Tertiary alcohol - Oxolane - Vinylogous acid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Secondary alcohol - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Acetal - Organoheterocyclic compound - Oxacycle - Ether - Carbonyl group - Organooxygen compound - Primary alcohol - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position.

External Descriptors

LIPIDMAPS (LMPK12112963) : Flavones and Flavonols

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