Compound Identification
SMILES
[Na].OC1C(O)C(OC(C1O)C(O)=O)N(O)C1=CC=C(OC2=CC=C(Cl)C=C2)C=C1
InChIKey
InChIKey=OZINGASLNWEVIM-UHFFFAOYSA-N
Formula
C18H18ClNNaO8
Mass
434.78
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Sugar acids and derivatives
-
Level 6
Glucuronic acid derivatives
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Level 7
Glucuronides
- Level 8 N-glucuronides
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Level 7
Glucuronides
-
Level 6
Glucuronic acid derivatives
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Level 5
Sugar acids and derivatives
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
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
Diphenylethers Hexoses Diarylethers Glycosylamines 1-hydroxylamino, 2-unsubstituted benzenoids Phenoxy compounds Phenol ethers N-phenylhydroxylamines Beta hydroxy acids and derivatives Chlorobenzenes Aryl chlorides Pyrans Oxanes Secondary alcohols Oxacyclic compounds Polyols Carboxylic acids Monocarboxylic acids and derivatives N-organohydroxylamines Organic alkali metal salts Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-glucuronide - 1-n-glucuronide - Diphenylether - Hexose monosaccharide - Diaryl ether - Glycosyl compound - N-glycosyl compound - 1-hydroxylamino, 2-unsubstituted benzenoid - Phenol ether - N-phenylhydroxylamine - Phenoxy compound - Beta-hydroxy acid - Chlorobenzene - Halobenzene - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyran - Oxane - Aryl chloride - Hydroxy acid - Monosaccharide - Secondary alcohol - Oxacycle - Organic alkali metal salt - N-organohydroxylamine - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Polyol - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Alcohol - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organic nitrogen compound - Organohalogen compound - Organic oxide - 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