Structure Information
Structure

Compound Identification

SMILES

OC1C(O)C(OC(=O)CCC(OS(O)(=O)=O)C2=CN=CC=C2)OC(C1O)C(O)=O

InChIKey

InChIKey=NWKXXTSFQMGWEB-UHFFFAOYSA-N

Formula

C15H19NO12S

Mass

437.37

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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

O-glucuronides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

O-glucuronide - 1-o-glucuronide - Fatty acid ester - Beta-hydroxy acid - Fatty acyl - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Pyridine - Pyran - Oxane - Monosaccharide - Hydroxy acid - Dicarboxylic acid or derivatives - Heteroaromatic compound - Organic sulfuric acid or derivatives - Secondary alcohol - Carboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Polyol - Carboxylic acid - Carboxylic acid derivative - Acetal - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Alcohol - 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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