EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:161909 - Phe-Trp-Asn

Default Structure
ChEBI IDCHEBI:161909
ChEBI NamePhe-Trp-Asn
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H27N5O5
Net Charge0
Average Mass465.510
Monoisotopic Mass465.20122
SMILESNC(=O)C[C@H](NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O
InChIInChI=1S/C24H27N5O5/c25-17(10-14-6-2-1-3-7-14)22(31)28-19(23(32)29-20(24(33)34)12-21(26)30)11-15-13-27-18-9-5-4-8-16(15)18/h1-9,13,17,19-20,27H,10-12,25H2,(H2,26,30)(H,28,31)(H,29,32)(H,33,34)/t17-,19-,20-/m0/s1
InChIKeyNJONQBYLTANINY-IHPCNDPISA-N
ChEBI Ontology
Outgoing Relation(s)
Phe-Trp-Asn (CHEBI:161909) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-oxobutanoic acid