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CHEBI:85518 - O-glutaconyl-L-carnitine

ChEBI IDCHEBI:85518
ChEBI NameO-glutaconyl-L-carnitine
Stars
ASCII NameO-glutaconyl-L-carnitine
DefinitionAn O-acyl-L-carnitine where the acyl group specified is glutaconyl.
Last Modified23 October 2015
Submitternamrata
DownloadsMolfile
FormulaC12H19NO6
Net Charge0
Average Mass273.285
Monoisotopic Mass273.12124
SMILESC[N+](C)(C)C[C@@H](CC(=O)[O-])OC(=O)/C=C/CC(=O)O
InChIInChI=1S/C12H19NO6/c1-13(2,3)8-9(7-11(16)17)19-12(18)6-4-5-10(14)15/h4,6,9H,5,7-8H2,1-3H3,(H-,14,15,16,17)/b6-4+/t9-/m1/s1
InChIKeyJXVUHLILXGZLFR-OTQAPUNGSA-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-glutaconyl-L-carnitine (CHEBI:85518) is a O-acyl-L-carnitine (CHEBI:75659)
O-glutaconyl-L-carnitine (CHEBI:85518) is a O-glutaconylcarnitine (CHEBI:86081)
IUPAC Name 
(3R)-3-{[(2E)-4-carboxybut-2-enoyl]oxy}-4-(trimethylazaniumyl)butanoate
Synonym  Source
(R)-glutaconylcarnitineChEBI
Manual XrefsDatabases
HMDB0013129HMDB