Structure Information
Structure

Compound Identification

SMILES

CC(=O)N[C@@H]1[C@@H](O)C[C@@](OCC2=CN(C[C@@H](O)[C@@H](O)[C@@H]3O[C@@](C[C@H](O)[C@H]3NC(C)=O)(OCC3=CN(C[C@@H](O)[C@@H](O)[C@@H]4O[C@@](C[C@H](O)[C@H]4N)(OCC4=CN(C[C@@H](O)[C@@H](O)[C@@H]5O[C@@](C[C@H](O)[C@H]5NC(C)=O)(OCC#C)C(O)=O)N=N4)C(O)=O)N=N3)C(O)=O)N=N2)(O[C@H]1[C@H](O)[C@H](O)CO)C(O)=O

InChIKey

InChIKey=SNZIBIDARPZUKF-COSLAANHSA-N

Formula

C54H79N13O32

Mass

1422.285

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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 - Aminoglycoside core - Neuraminic acid - C-glucuronide - Delta amino acid or derivatives - Tetracarboxylic acid or derivatives - Glycosyl compound - C-glycosyl compound - Amino saccharide - Ketal - Pyran - Oxane - 1,3-aminoalcohol - Azole - Heteroaromatic compound - Acetamide - 1,2,3-triazole - Secondary alcohol - Secondary carboxylic acid amide - Carboxamide group - Amino acid - Amino acid or derivatives - 1,2-aminoalcohol - Acetal - Acetylide - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Polyol - Carbonyl group - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organopnictogen compound - Organic oxide - Primary amine - Primary alcohol - Primary aliphatic amine - Organonitrogen compound - 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

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