Structure Information
Structure

Compound Identification

SMILES

OCC1O[C@@H](OC2=CC(O)=C3C(OC(=O)C=C3C3=CC=CC=C3)=C2)C(O)[C@@H](O)[C@@H]1O

InChIKey

InChIKey=KEEXAAKXZAAECE-VVWFOWEGSA-N

Formula

C21H20O9

Mass

416.382

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Neoflavonoids

Subclass

Neoflavonoid 7-O-glycosides

Intermediate Tree Nodes

Not available

Direct Parent

Neoflavonoid 7-O-glycosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Neoflavonoid-7-o-glycoside - Coumarin-7-o-glycoside - Coumarin o-glycoside - 4-phenylcoumarin - Phenolic glycoside - Hexose monosaccharide - Hydroxycoumarin - Coumarin - Glycosyl compound - O-glycosyl compound - Benzopyran - 1-benzopyran - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - Monocyclic benzene moiety - Benzenoid - Monosaccharide - Pyran - Oxane - Heteroaromatic compound - Secondary alcohol - Lactone - Organoheterocyclic compound - Oxacycle - Acetal - Polyol - Alcohol - Hydrocarbon derivative - Organic oxide - Primary alcohol - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as neoflavonoid 7-o-glycosides. These are 7-O-glycosylated neoflavonoids. Neoflavonoids are compounds with a structure based on the 4-phenylchromene backbone.

External Descriptors

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