O-sebacoylcarnitine (CHEBI:73057)

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ChEBI Name	O-sebacoylcarnitine

ChEBI ID	CHEBI:73057

ChEBI ASCII Name	O-sebacoylcarnitine

Definition	An O-acylcarnitine having sebacoyl as the acyl substituent.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C17H31NO6

Net Charge

Average Mass

345.43110

Monoisotopic Mass

345.21514

InChI

InChI=1S/C17H31NO6/c1-18(2,3)13-14(12-16(21)22)24-17(23)11-9-7-5-4-6-8-10-15(19)20/h14H,4-13H2,1-3H3,(H-,19,20,21,22)

InChIKey

GBFPILOKXGQZKW-UHFFFAOYSA-N

SMILES

C[N+](C)(C)CC(CC([O-])=O)OC(=O)CCCCCCCCC(O)=O

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology
Outgoing	O-sebacoylcarnitine (CHEBI:73057) has functional parent carnitine (CHEBI:17126) O-sebacoylcarnitine (CHEBI:73057) has role metabolite (CHEBI:25212) O-sebacoylcarnitine (CHEBI:73057) is a O-acylcarnitine (CHEBI:17387) O-sebacoylcarnitine (CHEBI:73057) is a ammonium betaine (CHEBI:35284) O-sebacoylcarnitine (CHEBI:73057) is a carboxylic ester (CHEBI:33308)

IUPAC Name

3-[(9-carboxynonanoyl)oxy]-4-(trimethylazaniumyl)butanoate

Synonyms	Sources
3-[(9-carboxynonanoyl)oxy]-4-(trimethylammonio)butanoate	IUPAC
sebacoylcarnitine	ChEBI

Citation	Type	Source
23315938	PubMed citation	Europe PMC

Last Modified

13 May 2013