Compound Identification
SMILES
OC[C@@H](O)[C@@H](O)[C@@H]1O[C@@](O)(C[C@H](O)[C@H]1NC(=O)CBr)C(O)=O
InChIKey
InChIKey=VYAFZVOEHUSLKM-AJKRCSPLSA-N
Formula
C11H18BrNO9
Mass
388.167
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
Sugar amino acids and derivatives
-
Level 7
Pyranoid amino acids and derivatives
-
Level 8
Neuraminic acids and derivatives
-
Level 9
N-acylneuraminic acids and derivatives
- Level 10 N-acylneuraminic acids
-
Level 9
N-acylneuraminic acids and derivatives
-
Level 8
Neuraminic acids and derivatives
-
Level 7
Pyranoid amino acids and derivatives
-
Level 6
Sugar amino acids and derivatives
-
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 - Sugar amino acids and derivatives - Pyranoid amino acids and derivatives - Neuraminic acids and derivatives - N-acylneuraminic acids and derivatives
Direct Parent
N-acylneuraminic acids
Alternative Parents
Neuraminic acids C-glucuronides C-glycosyl compounds Pyrans Alpha hydroxy acids and derivatives Oxanes Secondary carboxylic acid amides Secondary alcohols Hemiacetals Polyols Oxacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organonitrogen compounds Alkyl bromides Carbonyl compounds Hydrocarbon derivatives Primary alcohols Organobromides Organic oxides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
N-acylneuraminic acid - Neuraminic acid - C-glucuronide - C-glycosyl compound - Glycosyl compound - Alpha-hydroxy acid - Hydroxy acid - Oxane - Pyran - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Hemiacetal - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Primary alcohol - Hydrocarbon derivative - Organohalogen compound - Organobromide - Carbonyl group - Organic oxide - Organic nitrogen compound - Alcohol - Alkyl halide - Organonitrogen compound - Alkyl bromide - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acylneuraminic acids. These are neuraminic acids carrying an N-acyl substituent.
External Descriptors
Not available