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CHEBI:190052 - N-(alpha-Linolenoyl) Tyrosine

ChEBI IDCHEBI:190052
ChEBI NameN-(alpha-Linolenoyl) Tyrosine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H39NO4
Net Charge0
Average Mass441.612
Monoisotopic Mass441.28791
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C27H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(30)28-25(27(31)32)22-23-18-20-24(29)21-19-23/h3-4,6-7,9-10,18-21,25,29H,2,5,8,11-17,22H2,1H3,(H,28,30)(H,31,32)/b4-3-,7-6-,10-9-/t25-/m0/s1
InChIKeyDEQLZTQITSWABQ-GMOGWPNXSA-N
Species of MetaboliteComponentSourceComments
Brassica napus (ncbitaxon:3708) flower (BTO:0000469) MetaboLights (MTBLS3950)
ChEBI Ontology
Outgoing Relation(s)
N-(alpha-Linolenoyl) Tyrosine (CHEBI:190052) is a tyrosine derivative (CHEBI:62761)
IUPAC Name 
(2S)-3-(4-hydroxyphenyl)-2-[[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]amino]propanoic acid
Manual XrefsDatabases
29342147ChemSpider