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CHEBI:161195 - Met-Tyr-Thr

ChEBI IDCHEBI:161195
ChEBI NameMet-Tyr-Thr
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](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O
InChIInChI=1S/C18H27N3O6S/c1-10(22)15(18(26)27)21-17(25)14(9-11-3-5-12(23)6-4-11)20-16(24)13(19)7-8-28-2/h3-6,10,13-15,22-23H,7-9,19H2,1-2H3,(H,20,24)(H,21,25)(H,26,27)/t10-,13+,14+,15+/m1/s1
InChIKeyJHVNNUIQXOGAHI-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-Tyr-Thr (CHEBI:161195) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoic acid