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CHEBI:176711 - (4S)-4-[(2E)-2-Octenoyloxy]-4-(trimethylammonio)butanoate

ChEBI IDCHEBI:176711
ChEBI Name(4S)-4-[(2E)-2-Octenoyloxy]-4-(trimethylammonio)butanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H27NO4
Net Charge0
Average Mass285.384
Monoisotopic Mass285.19401
SMILESCCCCC/C=C/C(=O)O[C@@H](CCC(=O)[O-])[N+](C)(C)C
InChIInChI=1S/C15H27NO4/c1-5-6-7-8-9-10-15(19)20-13(16(2,3)4)11-12-14(17)18/h9-10,13H,5-8,11-12H2,1-4H3/b10-9+/t13-/m0/s1
InChIKeyYMIVWYONPRZBEJ-LXKVQUBZSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
ChEBI Ontology
Outgoing Relation(s)
(4S)-4-[(2E)-2-Octenoyloxy]-4-(trimethylammonio)butanoate (CHEBI:176711) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
(4S)-4-[(E)-oct-2-enoyl]oxy-4-(trimethylazaniumyl)butanoate
Manual XrefsDatabases
30776708ChemSpider
HMDB0013324HMDB