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Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@]1(C[C@H](O)[C@@H](O)[C@@H](O1)[C@@H](O)[C@H](O)CO)N1N=NN(C1=S)C1=CC=CC=C1

InChIKey

InChIKey=VVAUKKXCUFCAJT-UFZBQXAWSA-N

Formula

C17H22N4O8S

Mass

442.44

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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

C-glucuronides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

C-glucuronide - C-glycosyl compound - Glycosyl compound - Phenyltetrazole - Alpha-amino acid or derivatives - Monocyclic benzene moiety - Oxane - Pyran - Benzenoid - Tetrazole - Azole - Methyl ester - Heteroaromatic compound - Secondary alcohol - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Polyol - Oxacycle - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Primary alcohol - Alcohol - Organic oxide - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

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

External Descriptors

Not available

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