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CHEBI:86076 - O-propenoyl-D-carnitine

ChEBI IDCHEBI:86076
ChEBI NameO-propenoyl-D-carnitine
Stars
ASCII NameO-propenoyl-D-carnitine
DefinitionAn O-acyl-L-carnitine in which the acyl group specified is propenoyl.
Last Modified23 October 2015
Submitternamrata
DownloadsMolfile
FormulaC10H17NO4
Net Charge0
Average Mass215.249
Monoisotopic Mass215.11576
SMILESC=CC(=O)O[C@@H](CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C10H17NO4/c1-5-10(14)15-8(6-9(12)13)7-11(2,3)4/h5,8H,1,6-7H2,2-4H3/t8-/m0/s1
InChIKeyYUCNWOKTRWJLGY-QMMMGPOBSA-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-propenoyl-D-carnitine (CHEBI:86076) is a O-acyl-L-carnitine (CHEBI:75659)
O-propenoyl-D-carnitine (CHEBI:86076) is a O-propenoylcarnitine (CHEBI:86073)
IUPAC Name 
(3S)-3-(acryloyloxy)-4-(trimethylazaniumyl)butanoate
Synonym  Source
(3S)-3-(prop-2-enoyloxy)-4-(trimethylazaniumyl)butanoateChEBI
Manual XrefsDatabases
HMDB0013124HMDB