EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:161173 - Met-Tyr-Gln

ChEBI IDCHEBI:161173
ChEBI NameMet-Tyr-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H28N4O6S
Net Charge0
Average Mass440.522
Monoisotopic Mass440.17296
SMILESCSCC[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C19H28N4O6S/c1-30-9-8-13(20)17(26)23-15(10-11-2-4-12(24)5-3-11)18(27)22-14(19(28)29)6-7-16(21)25/h2-5,13-15,24H,6-10,20H2,1H3,(H2,21,25)(H,22,27)(H,23,26)(H,28,29)/t13-,14-,15-/m0/s1
InChIKeyNBEFNGUZUOUGFG-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)
Met-Tyr-Gln (CHEBI:161173) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoic acid