Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=CC(C)=NC(SCC2=CN(N=N2)C2=CC(C(F)F)=C(O[C@@]3(C[C@H](O)[C@@H](NC(C)=O)[C@@H](O3)[C@H](O)[C@H](O)CO)C(O)=O)C=C2)=C1C#N

InChIKey

InChIKey=AUFQQGPZNBWECD-SZSBFUAESA-N

Formula

C31H34F2N6O11S

Mass

736.7

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-acylneuraminic acid - Neuraminic acid - C-glucuronide - Phenyl-1,2,3-triazole - Phenyltriazole - C-glycosyl compound - Glycosyl compound - Phenoxyacetate - Pyridine carboxylic acid or derivatives - Pyridine carboxylic acid - Phenoxy compound - Aryl thioether - 3-pyridinecarbonitrile - Phenol ether - Alkylarylthioether - Methylpyridine - Ketal - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Oxane - Pyran - Pyridine - Benzenoid - Azole - Acetamide - 1,2,3-triazole - Triazole - Heteroaromatic compound - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Carboxylic acid ester - Thioether - Organoheterocyclic compound - Sulfenyl compound - Azacycle - Oxacycle - Acetal - Carboxylic acid derivative - Carboxylic acid - Carbonitrile - Nitrile - Polyol - Alcohol - Organic nitrogen compound - Primary alcohol - Cyanide - Organic oxide - Organopnictogen compound - Carbonyl group - Organohalogen compound - Organofluoride - Organonitrogen compound - Organosulfur compound - Alkyl fluoride - Hydrocarbon derivative - Alkyl halide - Aromatic 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

Previous Back Next