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Structure Information
Structure

Compound Identification

SMILES

O[C@H]1[C@H](O)[C@](O)(Br)[C@](Cl)(OC2=CC3=CC=CC=C3N2)O[C@@H]1C(O)=O

InChIKey

InChIKey=RJHXLGGYFLWTQT-GJKBLCTNSA-N

Formula

C14H13BrClNO7

Mass

422.61

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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 heteropolycyclic compounds

Substituents

O-glucuronide - 1-o-glucuronide - Indole or derivatives - Indole - Beta-hydroxy acid - Oxane - Monosaccharide - Pyran - Substituted pyrrole - Benzenoid - Hydroxy acid - Heteroaromatic compound - Pyrrole - Secondary alcohol - Chlorohydrin - Bromohydrin - Halohydrin - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Polyol - Alkyl halide - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Alkyl bromide - Alcohol - Carbonyl group - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organobromide - Aromatic heteropolycyclic 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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