Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(CO[C@@H]2[C@H](OCC3=CC=CC=C3)[C@@H](OCC3=CC=CC=C3)[C@@H](O[C@@H]3[C@H](OCC4=CC=CC=C4)[C@@H](OCC4=CC=CC=C4)[C@H](OCC4=CC=CC=C4)O[C@@H]3C(=O)OCC3=CC=CC=C3)O[C@@H]2C(=O)OCC2=CC=CC=C2)C=C1

InChIKey

InChIKey=QAOFUANNBJREGJ-SSIHPZSWSA-N

Formula

C69H68O14

Mass

1121.289

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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 heteromonocyclic compounds

Substituents

1-o-glucuronide - O-glucuronide - Disaccharide - Glycosyl compound - O-glycosyl compound - Benzyloxycarbonyl - Benzylether - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Pyran - Oxane - Carboxylic acid ester - Dialkyl ether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Ether - Acetal - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic 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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