EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:231152 - N-Linoleoyl Tyrosine

Default Structure
ChEBI IDCHEBI:231152
ChEBI NameN-Linoleoyl Tyrosine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H41NO4
Net Charge0
Average Mass443.628
Monoisotopic Mass443.30356
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C27H41NO4/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/h6-7,9-10,18-21,25,29H,2-5,8,11-17,22H2,1H3,(H,28,30)(H,31,32)/b7-6-,10-9-/t25-/m0/s1
InChIKeyKKUHRHHCDFHCIB-ABDCMALPSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
N-Linoleoyl Tyrosine (CHEBI:231152) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
(2S)-3-(4-hydroxyphenyl)-2-[[(9Z,12Z)-octadeca-9,12-dienoyl]amino]propanoic acid
Manual XrefsDatabases
65999163ChemSpider