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CHEBI:230778 - (2E)-4-Hydroxy-3-methylpent-2-enedioylcarnitine

ChEBI IDCHEBI:230778
ChEBI Name(2E)-4-Hydroxy-3-methylpent-2-enedioylcarnitine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H21NO7
Net Charge0
Average Mass303.311
Monoisotopic Mass303.13180
SMILESC/C(=C\C(=O)O)C(O)C(=O)OC(CC(=O)[O-])C[N+](C)(C)C
InChIInChI=1S/C13H21NO7/c1-8(5-10(15)16)12(19)13(20)21-9(6-11(17)18)7-14(2,3)4/h5,9,12,19H,6-7H2,1-4H3,(H-,15,16,17,18)/b8-5+
InChIKeyJBMXEKVFHRDFCQ-VMPITWQZSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
(2E)-4-Hydroxy-3-methylpent-2-enedioylcarnitine (CHEBI:230778) is a O-acylcarnitine (CHEBI:17387)
IUPAC Name 
3-[(E)-4-carboxy-2-hydroxy-3-methylbut-3-enoyl]oxy-4-(trimethylazaniumyl)butanoate