Structure Information
Structure

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

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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

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

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