Structure Information
Structure

Compound Identification

SMILES

CNC(=O)N1CCN(CC2=CC(=NC=C2)N(C2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)C2=NC=C(S2)[14C]#N)CC1

InChIKey

InChIKey=XLYJTPUDCKRSIT-JZFQBNRLSA-N

Formula

C22H27N7O7S

Mass

535.55

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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

N-glucuronides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-glucuronide - 1-n-glucuronide - Hexose monosaccharide - Alkyldiarylamine - Glycosyl compound - N-glycosyl compound - Piperazine-1-carboxamide - Beta-hydroxy acid - 2,5-disubstituted 1,3-thiazole - N-alkylpiperazine - Aralkylamine - Aminopyridine - Monosaccharide - Hydroxy acid - 1,4-diazinane - Oxane - 1,3-thiazol-2-amine - Piperazine - Pyran - Pyridine - Imidolactam - Thiazole - Heteroaromatic compound - Azole - Amino acid or derivatives - Amino acid - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Urea - Oxacycle - Azacycle - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Carboxylic acid - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Amine - Alcohol - Organic nitrogen compound - Cyanide - Organic oxide - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through a N-glycosidic bond.

External Descriptors

Not available

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