Structure Information
Structure

Compound Identification

SMILES

CC(=O)NC1C(O)CC(OCC2OC(OC3=CC=CC=C3[N+]([O-])=O)C(NC(C)=O)C(OC3OC(COS(O)(=O)=O)C(O)C(O)C3O)C2O)(OC1C(O)C(O)CO)C(O)=O

InChIKey

InChIKey=OEZIZRHPVJSYGR-UHFFFAOYSA-N

Formula

C31H45N3O24S

Mass

875.76

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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 - Neuraminic acid - Disaccharide sulfate - N-acyl-alpha-hexosamine - C-glucuronide - O-glycosyl compound - C-glycosyl compound - Disaccharide - Glycosyl compound - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Phenol ether - Ketal - Oxane - Pyran - Sulfuric acid monoester - Sulfate-ester - Monocyclic benzene moiety - Alkyl sulfate - Sulfuric acid ester - Benzenoid - Organic sulfuric acid or derivatives - Acetamide - Secondary alcohol - Organic nitro compound - Secondary carboxylic acid amide - Carboxamide group - C-nitro compound - Acetal - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Polyol - Organopnictogen compound - Organic oxide - Organic salt - Carbonyl group - Hydrocarbon derivative - Alcohol - Primary alcohol - Organonitrogen compound - Organic nitrogen compound - Organic cation - 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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