O-heptadecanoylcarnitine (CHEBI:131887)

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ChEBI Name	O-heptadecanoylcarnitine

ChEBI ID	CHEBI:131887

ChEBI ASCII Name	O-heptadecanoylcarnitine

Definition	An O-acylcarnitine in which the acyl group is specified as heptadecanoyl.

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

Supplier Information

Download	Molfile XML SDF

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Formula

C24H47NO4

Net Charge

Average Mass

413.635

Monoisotopic Mass

413.35051

InChI

InChI=1S/C24H47NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24(28)29-22(20-23(26)27)21-25(2,3)4/h22H,5-21H2,1-4H3

InChIKey

DWSFAVOTORHAAL-UHFFFAOYSA-N

SMILES

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

Roles Classification
Biological Role(s):	rat metabolite Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus). human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).

Application(s):	biomarker A substance used as an indicator of a biological state.

ChEBI Ontology
Outgoing	O-heptadecanoylcarnitine (CHEBI:131887) has functional parent heptadecanoic acid (CHEBI:32365) O-heptadecanoylcarnitine (CHEBI:131887) has role biomarker (CHEBI:59163) O-heptadecanoylcarnitine (CHEBI:131887) has role human metabolite (CHEBI:77746) O-heptadecanoylcarnitine (CHEBI:131887) has role rat metabolite (CHEBI:86264) O-heptadecanoylcarnitine (CHEBI:131887) is a O-acylcarnitine (CHEBI:17387)

IUPAC Name

3-(heptadecanoyloxy)-4-(trimethylazaniumyl)butanoate

Synonyms	Sources
3-Carboxy-N,N,N-trimethyl-2-[(1-oxoheptadecyl)oxy]-1-propanaminium inner salt	HMDB
C17 carnitine	ChEBI
Carnitine heptadecanoate	HMDB
Heptadecanoyl carnitine	HMDB
heptadecanoylcarnitine	ChEBI

Last Modified

06 December 2016