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CHEBI:77087 - O-hexadecanedioyl-L-carnitine(1−)

ChEBI IDCHEBI:77087
ChEBI NameO-hexadecanedioyl-L-carnitine(1−)
Stars
ASCII NameO-hexadecanedioyl-L-carnitine(1-)
DefinitionA dicarboxylic acid monoanion that is the conjugate base of O-hexadecanedioyl-L-carnitine; major spoecies at pH 7.3.
Last Modified4 February 2014
Submitterlaimo
DownloadsMolfile
FormulaC23H42NO6
Net Charge-1
Average Mass428.590
Monoisotopic Mass428.30176
SMILESC[N+](C)(C)C[C@@H](CC(=O)[O-])OC(=O)CCCCCCCCCCCCCCC(=O)[O-]
InChIInChI=1S/C23H43NO6/c1-24(2,3)19-20(18-22(27)28)30-23(29)17-15-13-11-9-7-5-4-6-8-10-12-14-16-21(25)26/h20H,4-19H2,1-3H3,(H-,25,26,27,28)/p-1/t20-/m1/s1
InChIKeyUNHCPLSWMNPZTD-HXUWFJFHSA-M
ChEBI Ontology
Outgoing Relation(s)
O-hexadecanedioyl-L-carnitine(1−) (CHEBI:77087) is a dicarboxylic acid monoanion (CHEBI:35695)
O-hexadecanedioyl-L-carnitine(1−) (CHEBI:77087) is a fatty acyl-L-carnitine (CHEBI:176910)
O-hexadecanedioyl-L-carnitine(1−) (CHEBI:77087) is conjugate base of O-hexadecanedioyl-L-carnitine (CHEBI:77237)
Incoming Relation(s)
O-hexadecanedioyl-L-carnitine (CHEBI:77237) is conjugate acid of O-hexadecanedioyl-L-carnitine(1−) (CHEBI:77087)
IUPAC Name 
16-{[(2R)-1-carboxylato-3-(trimethylazaniumyl)propan-2-yl]oxy}-16-oxohexadecanoate
Synonym  Source
O-DC16:0-L-carnitine(1−)SUBMITTER
UniProt Name  Source
O-hexadecanedioyl-L-carnitineUniProt