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CHEBI:161121 - Met-Thr-Tyr

ChEBI IDCHEBI:161121
ChEBI NameMet-Thr-Tyr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H27N3O6S
Net Charge0
Average Mass413.496
Monoisotopic Mass413.16206
SMILESCSCC[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O
InChIInChI=1S/C18H27N3O6S/c1-10(22)15(21-16(24)13(19)7-8-28-2)17(25)20-14(18(26)27)9-11-3-5-12(23)6-4-11/h3-6,10,13-15,22-23H,7-9,19H2,1-2H3,(H,20,25)(H,21,24)(H,26,27)/t10-,13+,14+,15+/m1/s1
InChIKeyNSMXRFMGZYTFEX-KJEVXHAQSA-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-Thr-Tyr (CHEBI:161121) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3R)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid