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CHEBI:84898 - (R)-crotonylcarnitine

ChEBI IDCHEBI:84898
ChEBI Name(R)-crotonylcarnitine
Stars
ASCII Name(R)-crotonylcarnitine
DefinitionA O-butenoyl-L-carnitine in which the acyl group is specified as crotonyl.
Secondary ChEBI IDCHEBI:86079
Last Modified15 July 2015
Submitternamrata, nhn
DownloadsMolfile
FormulaC11H19NO4
Net Charge0
Average Mass229.276
Monoisotopic Mass229.13141
SMILESC/C=C/C(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C11H19NO4/c1-5-6-11(15)16-9(7-10(13)14)8-12(2,3)4/h5-6,9H,7-8H2,1-4H3/b6-5+/t9-/m1/s1
InChIKeyHQDBMDGXEZLSNK-VUHVRTRXSA-N
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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)
(R)-crotonylcarnitine (CHEBI:84898) has functional parent crotonic acid (CHEBI:41131)
(R)-crotonylcarnitine (CHEBI:84898) is a (2E)-enoyl-L-carnitine (CHEBI:133450)
(R)-crotonylcarnitine (CHEBI:84898) is a O-butenoyl-L-carnitine (CHEBI:85480)
IUPAC Name 
(3R)-3-{[(2E)-but-2-enoyl]oxy}-4-(trimethylazaniumyl)butanoate
Synonyms  Source
crotonylcarnitineChEBI
crotonyl-L-carnitineChEBI
(2E)-butenoyl-L-carnitineChEBI
(2E)-butenoylcarnitineChEBI
UniProt Name  Source
O-(2E)-butenoyl-(R)-carnitineUniProt
Manual XrefsDatabases
HMDB0013126HMDB
Registry NumbersSources
Reaxys:7294299Reaxys
Citations