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CHEBI:74303 - O-heptanoylcarnitine

ChEBI IDCHEBI:74303
ChEBI NameO-heptanoylcarnitine
Stars
ASCII NameO-heptanoylcarnitine
DefinitionAn O-acylcarnitine that is the O-heptanoyl derivative of carnitine.
Last Modified15 December 2014
Submittermwilliams
DownloadsMolfile
FormulaC14H27NO4
Net Charge0
Average Mass273.373
Monoisotopic Mass273.19401
SMILESCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C14H27NO4/c1-5-6-7-8-9-14(18)19-12(10-13(16)17)11-15(2,3)4/h12H,5-11H2,1-4H3
InChIKeyVDPCTFWULDLKHT-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)
O-heptanoylcarnitine (CHEBI:74303) has functional parent heptanoic acid (CHEBI:45571)
O-heptanoylcarnitine (CHEBI:74303) has role metabolite (CHEBI:25212)
O-heptanoylcarnitine (CHEBI:74303) is a O-acylcarnitine (CHEBI:17387)
O-heptanoylcarnitine (CHEBI:74303) is a ammonium betaine (CHEBI:35284)
O-heptanoylcarnitine (CHEBI:74303) is a carboxylic ester (CHEBI:33308)
IUPAC Name 
3-(heptanoyloxy)-4-(trimethylammonio)butanoate
Manual XrefsDatabases
HMDB0013238HMDB