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CHEBI:68568 - O-adipoylcarnitine

ChEBI IDCHEBI:68568
ChEBI NameO-adipoylcarnitine
Stars
ASCII NameO-adipoylcarnitine
DefinitionAn O-acylcarnitine compound having adipoyl as the acyl substituent.
Last Modified16 July 2015
Submittermwilliams
DownloadsMolfile
FormulaC13H23NO6
Net Charge0
Average Mass289.328
Monoisotopic Mass289.15254
SMILESC[N+](C)(C)CC(CC(=O)[O-])OC(=O)CCCCC(=O)O
InChIInChI=1S/C13H23NO6/c1-14(2,3)9-10(8-12(17)18)20-13(19)7-5-4-6-11(15)16/h10H,4-9H2,1-3H3,(H-,15,16,17,18)
InChIKeyBSVHAXJKBCWVDA-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-adipoylcarnitine (CHEBI:68568) has functional parent adipic acid (CHEBI:30832)
O-adipoylcarnitine (CHEBI:68568) has role metabolite (CHEBI:25212)
O-adipoylcarnitine (CHEBI:68568) is a O-acylcarnitine (CHEBI:17387)
O-adipoylcarnitine (CHEBI:68568) is conjugate acid of O-adipoylcarnitine(1−) (CHEBI:77082)
Incoming Relation(s)
O-adipoyl-L-carnitine (CHEBI:86507) is a O-adipoylcarnitine (CHEBI:68568)
O-adipoylcarnitine(1−) (CHEBI:77082) is conjugate base of O-adipoylcarnitine (CHEBI:68568)
IUPAC Name 
3-[(5-carboxypentanoyl)oxy]-4-(trimethylazaniumyl)butanoate
Synonym  Source
3-[(5-carboxypentanoyl)oxy]-4-(trimethylammonio)butanoateIUPAC
Registry NumbersSources
Reaxys:14657154Reaxys
Citations