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CHEBI:73074 - O-stearoylcarnitine

ChEBI IDCHEBI:73074
ChEBI NameO-stearoylcarnitine
Stars
ASCII NameO-stearoylcarnitine
DefinitionAn O-acylcarnitine having stearoyl (octadecanoyl) as the acyl substituent.
Last Modified23 October 2015
Submittermwilliams
DownloadsMolfile
FormulaC25H49NO4
Net Charge0
Average Mass427.670
Monoisotopic Mass427.36616
SMILESCCCCCCCCCCCCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C25H49NO4/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/h23H,5-22H2,1-4H3
InChIKeyFNPHNLNTJNMAEE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (21886157)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
O-stearoylcarnitine (CHEBI:73074) has functional parent octadecanoic acid (CHEBI:28842)
O-stearoylcarnitine (CHEBI:73074) has role human metabolite (CHEBI:77746)
O-stearoylcarnitine (CHEBI:73074) is a O-acylcarnitine (CHEBI:17387)
IUPAC Name 
3-(octadecanoyloxy)-4-(trimethylazaniumyl)butanoate
Synonyms  Source
3-(octadecanoyloxy)-4-(trimethylammonio)butanoateIUPAC
Acylcarnitine C18:0HMDB
O-octadecanoylcarnitineChEBI
octadecanoylcarnitineChEBI
stearoylcarnitineChEBI
Manual XrefsDatabases
HMDB0000848HMDB
Registry NumbersSources
Reaxys:8731846Reaxys
Citations