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Structure Information
Structure

Compound Identification

SMILES

O[C@H]1[C@@H](O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O)SC1=NC2=CC=CC=C2S1

InChIKey

InChIKey=VDHSIRGTLHMXEI-LIJGXYGRSA-N

Formula

C13H13NO6S2

Mass

343.37

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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

S-glucuronides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

S-glucuronide - 1-s-glucuronide - Hexose monosaccharide - Glycosyl compound - S-glycosyl compound - 1,3-benzothiazole - Aryl thioether - Beta-hydroxy acid - Hydroxy acid - Monosaccharide - Oxane - Pyran - Benzenoid - Azole - Thiazole - Monothioacetal - Heteroaromatic compound - Secondary alcohol - Azacycle - Oxacycle - Sulfenyl compound - Polyol - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Organic oxide - Hydrocarbon derivative - Alcohol - Carbonyl group - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as s-glucuronides. These are carbohydrate derivatives containing glucuronic acid linked to another substance through a S-glycosidic bond.

External Descriptors

Not available

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