Structure Information
Structure

Compound Identification

SMILES

CC(=O)CCC(=O)O[C@H]1[C@H](OCC2=CC=CC=C2)[C@H](O[C@@H](O[C@@H]2[C@H]3CO[C@H](O3)[C@H](OC(=O)C3=CC=CC=C3)[C@H]2OCC2=CC=CC=C2)[C@@H]1OC(=O)C1=CC=CC=C1)C(=O)OCC1=CC=CC=C1

InChIKey

InChIKey=AGVKMQLETHWICW-UMQZDMAJSA-N

Formula

C52H50O15

Mass

914.957

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbohydrates and carbohydrate conjugates

Intermediate Tree Nodes

Sugar acids and derivatives - Glucuronic acid derivatives - Glucuronides

Direct Parent

O-glucuronides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-o-glucuronide - O-glucuronide - Tetracarboxylic acid or derivatives - Disaccharide - Glycosyl compound - O-glycosyl compound - Benzoate ester - Benzyloxycarbonyl - Benzoic acid or derivatives - Benzylether - Benzoyl - Gamma-keto acid - Fatty acid ester - Oxepane - Pyran - Keto acid - Benzenoid - Oxane - Monocyclic benzene moiety - Fatty acyl - Meta-dioxolane - Ketone - Carboxylic acid ester - Acetal - Ether - Organoheterocyclic compound - Dialkyl ether - Oxacycle - Carboxylic acid derivative - Hydrocarbon derivative - Aldehyde - Organic oxide - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as o-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through an O-glycosidic bond.

External Descriptors

Not available

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