Compound Identification
SMILES
OC(C(O)C(O)C(O)=O)C(O)C(O)=O.CCO\N=C(/C1CCN(CC1)C1(C)CCN(CC1)C(=O)C1=C(C)C=C[N+]([O-])=C1C)C1=CC=C(Br)C=C1
InChIKey
InChIKey=OVCMPUHOJWVIFF-AFCPYBGBSA-N
Formula
C34H47BrN4O11
Mass
767.671
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
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Level 5
Sugar acids and derivatives
- Level 6 Glucuronic acid derivatives
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Level 5
Sugar acids and derivatives
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
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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
Direct Parent
Glucuronic acid derivatives
Alternative Parents
Medium-chain hydroxy acids and derivatives N-acylpiperidines Pyridinecarboxylic acids and derivatives Medium-chain fatty acids Beta hydroxy acids and derivatives Hydroxy fatty acids Methylpyridines Aminopiperidines Bromobenzenes Aryl bromides Monosaccharides Dicarboxylic acids and derivatives Alpha hydroxy acids and derivatives Pyridinium derivatives Heteroaromatic compounds Tertiary carboxylic acid amides Vinylogous amides Trialkylamines Amino acids and derivatives Secondary alcohols Carboxylic acids Azacyclic compounds Polyols Organobromides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic cations
Molecular Framework
Not available
Substituents
Glucuronic acid or derivatives - Medium-chain hydroxy acid - N-acyl-piperidine - Pyridine carboxylic acid or derivatives - Medium-chain fatty acid - Halobenzene - Methylpyridine - 4-aminopiperidine - Hydroxy fatty acid - Bromobenzene - Beta-hydroxy acid - Dicarboxylic acid or derivatives - Alpha-hydroxy acid - Hydroxy acid - Monosaccharide - Fatty acyl - Fatty acid - Monocyclic benzene moiety - Piperidine - Pyridine - Pyridinium - Aryl bromide - Aryl halide - Benzenoid - Heteroaromatic compound - Vinylogous amide - Tertiary carboxylic acid amide - Carboxamide group - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Carboxylic acid - Polyol - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Alcohol - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Amine - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as glucuronic acid derivatives. These are compounds containing a glucuronic acid moiety (or a derivative), which consists of a glucose moiety with the C6 carbon oxidized to a carboxylic acid.
External Descriptors
Not available