Compound Identification
SMILES
CC(=O)N[C@@H]1[C@@H](O)C[C@](O)(O[C@H]1[C@H](O)[C@H](O)CO)C(=O)N1C(=O)C2=CC=CC=C2S1(=O)=O
InChIKey
InChIKey=XFYOBKQBBWVGMJ-ULPPIJFESA-N
Formula
C18H22N2O11S
Mass
474.44
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
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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
Direct Parent
N-acylneuraminic acids and derivatives
Alternative Parents
C-glycosyl compounds Benzothiazoles Pyrans Oxanes Benzenoids Acetamides Organosulfonic acids and derivatives Dicarboximides Secondary carboxylic acid amides Secondary alcohols 1,2-diols Hemiacetals Oxacyclic compounds Azacyclic compounds Organic oxides Organonitrogen compounds Primary alcohols Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acylneuraminic acid or derivatives - C-glycosyl compound - Glycosyl compound - 1,2-benzothiazole - Benzenoid - Pyran - Oxane - Dicarboximide - Acetamide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - 1,2-diol - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Hemiacetal - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Polyol - Alcohol - Organic nitrogen compound - Carbonyl group - Organic oxide - Primary alcohol - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acylneuraminic acids and derivatives. These are neuraminic acids (or derivatives thereof) carrying an N-acyl substituent.
External Descriptors
Not available