EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:162583 - Gln-Tyr-Gln

ChEBI IDCHEBI:162583
ChEBI NameGln-Tyr-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H27N5O7
Net Charge0
Average Mass437.453
Monoisotopic Mass437.19105
SMILESNC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O
InChIInChI=1S/C19H27N5O7/c20-12(5-7-15(21)26)17(28)24-14(9-10-1-3-11(25)4-2-10)18(29)23-13(19(30)31)6-8-16(22)27/h1-4,12-14,25H,5-9,20H2,(H2,21,26)(H2,22,27)(H,23,29)(H,24,28)(H,30,31)/t12-,13-,14-/m0/s1
InChIKeyCMBXOSFZCFGDLE-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)
Gln-Tyr-Gln (CHEBI:162583) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoic acid