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CHEBI:231162 - N-Linoleoyl Tryptophan

ChEBI IDCHEBI:231162
ChEBI NameN-Linoleoyl Tryptophan
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H42N2O3
Net Charge0
Average Mass466.666
Monoisotopic Mass466.31954
SMILESCCCCC/C=C/C/C=C/CCCCCCCC(=O)NC(Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C29H42N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-28(32)31-27(29(33)34)22-24-23-30-26-20-18-17-19-25(24)26/h6-7,9-10,17-20,23,27,30H,2-5,8,11-16,21-22H2,1H3,(H,31,32)(H,33,34)/b7-6+,10-9+
InChIKeyVMJGIIURAHPLEX-AVQMFFATSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
N-Linoleoyl Tryptophan (CHEBI:231162) is a N-acyl-amino acid (CHEBI:51569)
IUPAC Name 
3-(1H-indol-3-yl)-2-[[(9E,12E)-octadeca-9,12-dienoyl]amino]propanoic acid
Manual XrefsDatabases
128530245ChemSpider