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CHEBI:73050 - (2E)-7-carboxyhept-2-enoylcarnitine

ChEBI IDCHEBI:73050
ChEBI Name(2E)-7-carboxyhept-2-enoylcarnitine
Stars
ASCII Name(2E)-7-carboxyhept-2-enoylcarnitine
DefinitionAn O-acylcarnitine having (2E)-7-carboxyhept-2-enoyl as the acyl substituent.
Last Modified13 May 2013
Submittermwilliams
DownloadsMolfile
FormulaC15H25NO6
Net Charge0
Average Mass315.366
Monoisotopic Mass315.16819
SMILESC[N+](C)(C)C(CCC(=O)[O-])OC(=O)/C=C/CCCCC(=O)O
InChIInChI=1S/C15H25NO6/c1-16(2,3)12(10-11-14(19)20)22-15(21)9-7-5-4-6-8-13(17)18/h7,9,12H,4-6,8,10-11H2,1-3H3,(H-,17,18,19,20)/b9-7+
InChIKeyXRUHWUXLQZMBGC-VQHVLOKHSA-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)
(2E)-7-carboxyhept-2-enoylcarnitine (CHEBI:73050) has functional parent carnitine (CHEBI:17126)
(2E)-7-carboxyhept-2-enoylcarnitine (CHEBI:73050) has role metabolite (CHEBI:25212)
(2E)-7-carboxyhept-2-enoylcarnitine (CHEBI:73050) is a O-acylcarnitine (CHEBI:17387)
(2E)-7-carboxyhept-2-enoylcarnitine (CHEBI:73050) is a ammonium betaine (CHEBI:35284)
(2E)-7-carboxyhept-2-enoylcarnitine (CHEBI:73050) is a carboxylic ester (CHEBI:33308)
IUPAC Name 
4-{[(2E)-7-carboxyhept-2-enoyl]oxy}-4-(trimethylammonio)butanoate
Synonym  Source
cis-7-carboxyhept-2-enoylcarnitineChEBI
Citations