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CHEBI:89746 - 3, 5-Tetradecadiencarnitine

ChEBI IDCHEBI:89746
ChEBI Name3, 5-Tetradecadiencarnitine
Stars
Last Modified7 October 2019
DownloadsMolfile
FormulaC21H37NO4
Net Charge0
Average Mass367.530
Monoisotopic Mass367.27226
SMILESCCCCCCCC/C=C/C=C/CC(=O)O[C@@H](CCC(=O)[O-])[N+](C)(C)C
InChIInChI=1S/C21H37NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-21(25)26-19(22(2,3)4)17-18-20(23)24/h12-15,19H,5-11,16-18H2,1-4H3/b13-12+,15-14+/t19-/m0/s1
InChIKeyHXOGMKPCIDSSKJ-NKBLVAAJSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) PubMed (24023812)
ChEBI Ontology
Outgoing Relation(s)
3, 5-Tetradecadiencarnitine (CHEBI:89746) is a polyunsaturated fatty ester (CHEBI:145039)
Synonyms  Source
(E,E)-3, 5-tetradecadiencarnitineHMDB
(3E,5E)-tetradecadiencarnitineHMDB
(4S)-4-[(3E,5E)-tetradeca-3,5-dienoyloxy]-4-(trimethylazaniumyl)butanoateHMDB
(3E,5E)-tetradecadienoylcarnitineHMDB
Manual XrefsDatabases
HMDB0013331HMDB
Citations