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CHEBI:86049 - O-pivaloylcarnitine

ChEBI IDCHEBI:86049
ChEBI NameO-pivaloylcarnitine
Stars
ASCII NameO-pivaloylcarnitine
DefinitionA C5-acylcarnitine in which the acyl group specified is pivaloyl.
Last Modified15 July 2015
Submitternamrata
DownloadsMolfile
FormulaC12H23NO4
Net Charge0
Average Mass245.319
Monoisotopic Mass245.16271
SMILESCC(C)(C)C(=O)O[C@@H](CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C12H23NO4/c1-12(2,3)11(16)17-9(7-10(14)15)8-13(4,5)6/h9H,7-8H2,1-6H3/t9-/m0/s1
InChIKeyYICAQFPUDACYGQ-VIFPVBQESA-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-pivaloylcarnitine (CHEBI:86049) has functional parent pivalic acid (CHEBI:45133)
O-pivaloylcarnitine (CHEBI:86049) has role metabolite (CHEBI:25212)
O-pivaloylcarnitine (CHEBI:86049) is a C5-acylcarnitine (CHEBI:86492)
IUPAC Name 
3-[(2,2-dimethylpropanoyl)oxy]-4-(trimethylazaniumyl)butanoate
Manual XrefsDatabases
HMDB0041993HMDB