EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:163136 - Glu-Phe-Arg

ChEBI IDCHEBI:163136
ChEBI NameGlu-Phe-Arg
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30N6O6
Net Charge0
Average Mass450.496
Monoisotopic Mass450.22268
SMILESNC(N)=NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O
InChIInChI=1S/C20H30N6O6/c21-13(8-9-16(27)28)17(29)26-15(11-12-5-2-1-3-6-12)18(30)25-14(19(31)32)7-4-10-24-20(22)23/h1-3,5-6,13-15H,4,7-11,21H2,(H,25,30)(H,26,29)(H,27,28)(H,31,32)(H4,22,23,24)/t13-,14-,15-/m0/s1
InChIKeyKJBGAZSLZAQDPV-KKUMJFAQSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Glu-Phe-Arg (CHEBI:163136) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-amino-5-[[(2S)-1-[[(1S)-1-carboxy-4-(diaminomethylideneamino)butyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-5-oxopentanoic acid
Manual XrefsDatabases
16570602ChemSpider