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CHEBI:85470 - O-malonyl-L-carnitine

Default Structure
ChEBI IDCHEBI:85470
ChEBI NameO-malonyl-L-carnitine
Stars
ASCII NameO-malonyl-L-carnitine
DefinitionAn O-acyl-L-carnitine in which the acyl group is specified as malonyl.
Last Modified23 October 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-/m1/s1
InChIKeyZGNBLKBZJBJFDG-SSDOTTSWSA-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-malonyl-L-carnitine (CHEBI:85470) has functional parent malonic acid (CHEBI:30794)
O-malonyl-L-carnitine (CHEBI:85470) has role metabolite (CHEBI:25212)
O-malonyl-L-carnitine (CHEBI:85470) is a O-acyl-L-carnitine (CHEBI:75659)
O-malonyl-L-carnitine (CHEBI:85470) is enantiomer of O-malonyl-D-carnitine (CHEBI:86047)
Incoming Relation(s)
O-malonyl-D-carnitine (CHEBI:86047) is enantiomer of O-malonyl-L-carnitine (CHEBI:85470)
IUPAC Name 
(3R)-3-[(carboxyacetyl)oxy]-4-(trimethylazaniumyl)butanoate
Manual XrefsDatabases
HMDB0002095HMDB