Compound Identification
SMILES
[Na+].CC(=O)N[C@@H]1[C@@H](O)C[C@@](OC[C@H]2O[C@@H](O[C@H]3[C@H](O)[C@@H](O)C(O)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@H]2O)(O[C@H]1[C@H](O)[C@H](O)CO)C([O-])=O
InChIKey
InChIKey=GNRWSMYCXVSPHE-RCQPOWRYSA-M
Formula
C23H38NNaO19
Mass
655.535
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 Disaccharides O-glycosyl compounds Ketals Oxanes Pyrans Acetamides Carboxylic acid salts Secondary carboxylic acid amides Hemiacetals Secondary alcohols Oxacyclic compounds Polyols Carboxylic acids Monocarboxylic acids and derivatives Organic zwitterions Organonitrogen compounds Primary alcohols Organopnictogen compounds Hydrocarbon derivatives Organic sodium salts Carbonyl compounds Organic oxides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
N-acylneuraminic acid - Neuraminic acid - C-glucuronide - C-glycosyl compound - Disaccharide - Glycosyl compound - O-glycosyl compound - Ketal - Oxane - Pyran - Acetamide - Carboxamide group - Carboxylic acid salt - Hemiacetal - Secondary carboxylic acid amide - Secondary alcohol - Acetal - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organic alkali metal salt - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Polyol - Organopnictogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic sodium salt - Carbonyl group - Organic oxide - Organic salt - Organonitrogen compound - Organic zwitterion - Alcohol - Primary alcohol - 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