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CHEBI:91164 - O-(2-octadecenoyl)carnitine

ChEBI IDCHEBI:91164
ChEBI NameO-(2-octadecenoyl)carnitine
Stars
ASCII NameO-(2-octadecenoyl)carnitine
DefinitionAn O-acylcarnitine in which the acyl group is specified as 2-octadecenoyl.
Last Modified12 February 2016
SubmitterSteve
DownloadsMolfile
FormulaC25H47NO4
Net Charge0
Average Mass425.654
Monoisotopic Mass425.35051
SMILESCCCCCCCCCCCCCCCC=CC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C25H47NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h19-20,23H,5-18,21-22H2,1-4H3
InChIKeyYIGBMCKQXUEBKC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - MetaboLights (MTBLS192)
ChEBI Ontology
Outgoing Relation(s)
O-(2-octadecenoyl)carnitine (CHEBI:91164) is a O-acylcarnitine (CHEBI:17387)
IUPAC Name 
3-[(octadec-2-enoyl)oxy]-4-(trimethylazaniumyl)butanoate
Synonym  Source
octadece-2-enoylcarnitineChEBI