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CHEBI:73077 - 3-hydroxyoctadecanoylcarnitine

ChEBI IDCHEBI:73077
ChEBI Name3-hydroxyoctadecanoylcarnitine
Stars
DefinitionAn O-acylcarnitine having 3-hydroxyoctadecanoyl as the acyl substituent.
Last Modified14 May 2013
Submittermwilliams
DownloadsMolfile
FormulaC25H49NO5
Net Charge0
Average Mass443.669
Monoisotopic Mass443.36107
SMILESCCCCCCCCCCCCCCCC(O)CC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C25H49NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(27)19-25(30)31-23(20-24(28)29)21-26(2,3)4/h22-23,27H,5-21H2,1-4H3
InChIKeyPWZJXSPDNGIODC-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
3-hydroxyoctadecanoylcarnitine (CHEBI:73077) has functional parent carnitine (CHEBI:17126)
3-hydroxyoctadecanoylcarnitine (CHEBI:73077) has role metabolite (CHEBI:25212)
3-hydroxyoctadecanoylcarnitine (CHEBI:73077) is a O-acylcarnitine (CHEBI:17387)
3-hydroxyoctadecanoylcarnitine (CHEBI:73077) is a ammonium betaine (CHEBI:35284)
3-hydroxyoctadecanoylcarnitine (CHEBI:73077) is a carboxylic ester (CHEBI:33308)
IUPAC Name 
3-[(3-hydroxyoctadecanoyl)oxy]-4-(trimethylazaniumyl)butanoate
Synonyms  Source
3-hydroxystearoylcarnitineChEBI
3-[(3-hydroxyoctadecanoyl)oxy]-4-(trimethylammonio)butanoateIUPAC
Citations