Structure Information
Structure

Compound Identification

SMILES

CC(=O)N[C@@H]1[C@@H](O)C[C@@](OCC(=O)N[C@@H]2[C@@H](O)C[C@@](OCC3=CC=CC=C3)(O[C@H]2[C@H](O)[C@H](O)CO)C(O)=O)(O[C@H]1[C@H](O)[C@H](O)CO)C(O)=O

InChIKey

InChIKey=SAAXGHQTRABWRK-WTVDEBISSA-N

Formula

C29H42N2O18

Mass

706.651

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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 - C-glucuronide - C-glycosyl compound - Glycosyl compound - Ketal - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Pyran - Oxane - Acetamide - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Acetal - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Polyol - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organopnictogen compound - Primary alcohol - Organonitrogen compound - Organic oxide - 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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