Structure Information
Structure

Compound Identification

SMILES

CC(C)C(=O)O[C@H](CC([O-])=O)C[N+](C)(C)C

InChIKey

InChIKey=LRCNOZRCYBNMEP-SECBINFHSA-N

Formula

C11H21NO4

Mass

231.292

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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

Branched fatty acids Dicarboxylic acids and derivatives Tetraalkylammonium salts Carboxylic acid salts Carboxylic acid esters Carboxylic acids Organopnictogen compounds Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines

Molecular Framework

Aliphatic acyclic compounds

Substituents

Acyl-carnitine - Branched fatty acid - Dicarboxylic acid or derivatives - Tetraalkylammonium salt - Quaternary ammonium salt - Carboxylic acid ester - Carboxylic acid salt - Carboxylic acid derivative - Carboxylic acid - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Amine - Organooxygen compound - Organic salt - Aliphatic acyclic 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

CHEBI:84838 : O-acyl-L-carnitine - O-isobutyrylcarnitine

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