EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:161483 - Phe-Glu-Gln

ChEBI IDCHEBI:161483
ChEBI NamePhe-Glu-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26N4O7
Net Charge0
Average Mass422.438
Monoisotopic Mass422.18015
SMILESNC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O
InChIInChI=1S/C19H26N4O7/c20-12(10-11-4-2-1-3-5-11)17(27)22-13(7-9-16(25)26)18(28)23-14(19(29)30)6-8-15(21)24/h1-5,12-14H,6-10,20H2,(H2,21,24)(H,22,27)(H,23,28)(H,25,26)(H,29,30)/t12-,13-,14-/m0/s1
InChIKeyCDQCFGOQNYOICK-IHRRRGAJSA-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)
Phe-Glu-Gln (CHEBI:161483) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-5-oxopentanoic acid