Structure Information
Structure

Compound Identification

SMILES

O=C1NS(=O)(=O)C2=CC=CC=C12.CCC(=O)O[C@H](CC([O-])=O)C[N+](C)(C)C

InChIKey

InChIKey=YFADRVVGEZKOSU-DDWIOCJRSA-N

Formula

C17H24N2O7S

Mass

400.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acid esters

Intermediate Tree Nodes

Not available

Direct Parent

Acyl carnitines

Alternative Parents

Molecular Framework

Not available

Substituents

Acyl-carnitine - 1,2-benzothiazole - Dicarboxylic acid or derivatives - Benzenoid - Tetraalkylammonium salt - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Carboxylic acid ester - Carboxylic acid salt - Organoheterocyclic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Amine - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic salt - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as acyl carnitines. These are organic compounds containing a fatty acid with the carboxylic acid attached to carnitine through an ester bond.

External Descriptors

Not available

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