Compound Identification
SMILES
C[C@H]1O[C@@H](O[C@@H]2[C@@H](NC(C)=O)[C@H](OCCCCCCNC(=O)C3CCC(CCN4C(=O)C=CC4=O)CC3)O[C@H](CO)[C@H]2O[C@@]2(C[C@@H](O)[C@H](NC(C)=O)[C@H](O2)C(O)[C@H](O)CO)C(O)=O)[C@@H](O)[C@@H](O)[C@@H]1O
InChIKey
InChIKey=RCUVCQHZDMBIDT-TYUPSLPQSA-N
Formula
C44H70N4O21
Mass
991.051
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
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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 Fatty acyl glycosides of mono- and disaccharides N-acyl-alpha-hexosamines C-glucuronides Alkyl glycosides C-glycosyl compounds Disaccharides O-glycosyl compounds Ketals Maleimides Pyrans Oxanes N-substituted carboxylic acid imides Acetamides Pyrrolines Dicarboximides Secondary carboxylic acid amides Secondary alcohols Oxacyclic compounds Polyols Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organopnictogen compounds Hydrocarbon derivatives Primary alcohols Carbonyl compounds Organonitrogen compounds Organic oxides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
N-acylneuraminic acid - Neuraminic acid - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - N-acyl-alpha-hexosamine - C-glucuronide - Alkyl glycoside - C-glycosyl compound - Disaccharide - Glycosyl compound - O-glycosyl compound - Ketal - Maleimide - Pyran - Oxane - Fatty acyl - Carboxylic acid imide, n-substituted - Pyrroline - Carboxylic acid imide - Dicarboximide - Acetamide - Secondary alcohol - Secondary carboxylic acid amide - Carboxamide group - Acetal - Polyol - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Carbonyl group - 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