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CHEBI:164329 - Thr-Tyr-Gln

ChEBI IDCHEBI:164329
ChEBI NameThr-Tyr-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H26N4O7
Net Charge0
Average Mass410.427
Monoisotopic Mass410.18015
SMILESC[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C18H26N4O7/c1-9(23)15(20)17(27)22-13(8-10-2-4-11(24)5-3-10)16(26)21-12(18(28)29)6-7-14(19)25/h2-5,9,12-13,15,23-24H,6-8,20H2,1H3,(H2,19,25)(H,21,26)(H,22,27)(H,28,29)/t9-,12+,13+,15+/m1/s1
InChIKeyKAJRRNHOVMZYBL-IRIUXVKKSA-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)
Thr-Tyr-Gln (CHEBI:164329) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoic acid