Structure Information
Structure

Compound Identification

SMILES

[K+].CC(=O)C1=C(C2=CC=C(Cl)C=C2)C(=NN(CCO[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C([O-])=O)C1=O)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=QNFXUWPXMXXSEX-RDUMRAHYSA-M

Formula

C26H23Cl2KN2O9

Mass

617.47

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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 - Hexose monosaccharide - Phenylpyridazine - Glycosyl compound - O-glycosyl compound - Aryl ketone - Aryl alkyl ketone - Pyridazinone - Chlorobenzene - Halobenzene - Beta-hydroxy acid - Pyran - Hydroxy acid - Benzenoid - Oxane - Aryl halide - Pyridazine - Monocyclic benzene moiety - Aryl chloride - Monosaccharide - Vinylogous amide - Heteroaromatic compound - Ketone - Lactam - Carboxylic acid salt - Secondary alcohol - Carboxylic acid derivative - Organoheterocyclic compound - Organic alkali metal salt - Azacycle - Monocarboxylic acid or derivatives - Organic metal halide - Oxacycle - Acetal - Carboxylic acid - Polyol - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organic zwitterion - Organic salt - Carbonyl group - Organic potassium salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Aldehyde - 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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