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CHEBI:86047 - O-malonyl-D-carnitine

Default Structure
ChEBI IDCHEBI:86047
ChEBI NameO-malonyl-D-carnitine
Stars
ASCII NameO-malonyl-D-carnitine
DefinitionAn O-acyl-D-carnitine in which the acyl group specified is malonyl.
Last Modified17 June 2015
Submitternamrata
DownloadsMolfile
FormulaC10H17NO6
Net Charge0
Average Mass247.247
Monoisotopic Mass247.10559
SMILESC[N+](C)(C)C[C@H](CC(=O)[O-])OC(=O)CC(=O)O
InChIInChI=1S/C10H17NO6/c1-11(2,3)6-7(4-8(12)13)17-10(16)5-9(14)15/h7H,4-6H2,1-3H3,(H-,12,13,14,15)/t7-/m0/s1
InChIKeyZGNBLKBZJBJFDG-ZETCQYMHSA-N
ChEBI Ontology
Outgoing Relation(s)
O-malonyl-D-carnitine (CHEBI:86047) has functional parent malonic acid (CHEBI:30794)
O-malonyl-D-carnitine (CHEBI:86047) is a O-acyl-D-carnitine (CHEBI:86043)
O-malonyl-D-carnitine (CHEBI:86047) is enantiomer of O-malonyl-L-carnitine (CHEBI:85470)
Incoming Relation(s)
O-malonyl-L-carnitine (CHEBI:85470) is enantiomer of O-malonyl-D-carnitine (CHEBI:86047)
IUPAC Name 
(3S)-3-[(carboxyacetyl)oxy]-4-(trimethylazaniumyl)butanoate