Structure Information
Structure

Compound Identification

SMILES

CNS(=O)(=O)CC1=CC2=C(NC=C2CC(=O)O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)C=C1

InChIKey

InChIKey=LITWLFMIHOIPGH-RNGZQALNSA-N

Formula

C18H22N2O10S

Mass

458.44

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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 - Indole-3-acetic acid derivative - 3-alkylindole - Indole - Indole or derivatives - Beta-hydroxy acid - Dicarboxylic acid or derivatives - Hydroxy acid - Monosaccharide - Oxane - Pyran - Substituted pyrrole - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Pyrrole - Secondary alcohol - Carboxylic acid ester - Carboxylic acid derivative - Carboxylic acid - Polyol - Acetal - Azacycle - Oxacycle - Organoheterocyclic compound - Organosulfur compound - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Carbonyl group - Organic oxide - Organonitrogen compound - 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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