Structure Information
Structure

Compound Identification

SMILES

C1CNC(C1)\C=C/C1=CN=CC=C1.O[C@@H]([C@@H](O)[C@H](O)C(O)=O)[C@H](O)C(O)=O

InChIKey

InChIKey=SJKOOTFISISUKE-KQNYAFHOSA-N

Formula

C17H24N2O8

Mass

384.385

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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

Direct Parent

Glucuronic acid derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Glucuronic acid or derivatives - Medium-chain hydroxy acid - Medium-chain fatty acid - Beta-hydroxy acid - Hydroxy fatty acid - Alpha-hydroxy acid - Dicarboxylic acid or derivatives - Hydroxy acid - Monosaccharide - Pyridine - Fatty acid - Fatty acyl - Pyrrolidine - Heteroaromatic compound - Secondary alcohol - 1,2-diol - Organoheterocyclic compound - Azacycle - Secondary amine - Polyol - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Carbonyl group - Organic nitrogen compound - Alcohol - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as glucuronic acid derivatives. These are compounds containing a glucuronic acid moiety (or a derivative), which consists of a glucose moiety with the C6 carbon oxidized to a carboxylic acid.

External Descriptors

Not available

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