CHEBI:131887 - O-heptadecanoylcarnitine

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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 No supplier information found for this compound.
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Formula C24H47NO4
Net Charge 0
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-]
Metabolite of Species Details
Rattus norvegicus (NCBI:txid10116) See: MetaboLights Study
Rattus norvegicus (NCBI:txid10116) See: PubMed
Homo sapiens (NCBI:txid9606) See: PubMed
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.
View more via ChEBI Ontology
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
Manual Xrefs Databases
HMDB0006210 HMDB
LMFA07070067 LIPID MAPS
View more database links
Citations
Liu J, Chen XX, Li XW, Fu W, Zhang WQ (2016)
Metabolomic Research on Newborn Infants With Intrauterine Growth Restriction.
Medicine 95, e3564 [PubMed:27124067]
[show Abstract]
Malvagia S, Haynes CA, Grisotto L, Ombrone D, Funghini S, Moretti E, McGreevy KS, Biggeri A, Guerrini R, Yahyaoui R, Garg U, Seeterlin M, Chace D, De Jesus VR, la Marca G (2015)
Heptadecanoylcarnitine (C17) a novel candidate biomarker for newborn screening of propionic and methylmalonic acidemias.
Clinica chimica acta; international journal of clinical chemistry 450, 342-348 [PubMed:26368264]
[show Abstract]
Minkler PE, Stoll MS, Ingalls ST, Yang S, Kerner J, Hoppel CL (2008)
Quantification of carnitine and acylcarnitines in biological matrices by HPLC electrospray ionization-mass spectrometry.
Clinical chemistry 54, 1451-1462 [PubMed:18678604]
[show Abstract]
Minkler PE, Kerner J, North KN, Hoppel CL (2005)
Quantitation of long-chain acylcarnitines by HPLC/fluorescence detection: application to plasma and tissue specimens from patients with carnitine palmitoyltransferase-II deficiency.
Clinica chimica acta; international journal of clinical chemistry 352, 81-92 [PubMed:15653102]
[show Abstract]
Last Modified
06 December 2016