Compound Identification
SMILES
COCCOC(=O)NCC(=O)N[C@@H]1[C@@H](O)C[C@@](OC[C@H]2O[C@H](O[C@H](C)[C@H](N)C(O)=O)[C@H](NC(C)=O)[C@@H](O)[C@H]2O)(O[C@H]1[C@H](O)[C@H](O)CO)C(O)=O
InChIKey
InChIKey=GAQMWPRWVIGRRV-IVDGIBIRSA-N
Formula
C27H46N4O19
Mass
730.674
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
Glycosyl-amino acids Neuraminic acids Fatty acyl glycosides of mono- and disaccharides N-acyl-alpha-hexosamines C-glucuronides Alpha amino acid amides O-glycosyl compounds C-glycosyl compounds L-alpha-amino acids Heterocyclic fatty acids Hydroxy fatty acids Ketals Monosaccharides Pyrans Dicarboxylic acids and derivatives Oxanes Carbamate esters Acetamides Secondary carboxylic acid amides Secondary alcohols Amino acids Polyols Oxacyclic compounds Carboxylic acids Dialkyl ethers Monoalkylamines Organic oxides Carbonyl compounds Primary alcohols Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
N-acylneuraminic acid - Glycosyl-amino-acid - Neuraminic acid - N-acyl-alpha-hexosamine - Fatty acyl glycoside of mono- or disaccharide - Fatty acyl glycoside - C-glucuronide - Alpha-amino acid amide - O-glycosyl compound - Glycosyl compound - C-glycosyl compound - Alpha-amino acid - Alpha-amino acid or derivatives - N-substituted-alpha-amino acid - L-alpha-amino acid - Ketal - Heterocyclic fatty acid - Hydroxy fatty acid - Pyran - Monosaccharide - Oxane - Fatty acid - Fatty acyl - Dicarboxylic acid or derivatives - Acetamide - Carbamic acid ester - Amino acid - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Polyol - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Acetal - Ether - Organoheterocyclic compound - Carbonyl group - Primary alcohol - Hydrocarbon derivative - Primary aliphatic amine - Primary amine - Organopnictogen compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Amine - 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