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CHEBI:163843 - Thr-Gln-Tyr

ChEBI IDCHEBI:163843
ChEBI NameThr-Gln-Tyr
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](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C18H26N4O7/c1-9(23)15(20)17(27)21-12(6-7-14(19)25)16(26)22-13(18(28)29)8-10-2-4-11(24)5-3-10/h2-5,9,12-13,15,23-24H,6-8,20H2,1H3,(H2,19,25)(H,21,27)(H,22,26)(H,28,29)/t9-,12+,13+,15+/m1/s1
InChIKeyRCEHMXVEMNXRIW-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-Gln-Tyr (CHEBI:163843) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-5-amino-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-5-oxopentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid