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CHEBI:161079 - Met-Ser-Thr

ChEBI IDCHEBI:161079
ChEBI NameMet-Ser-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H23N3O6S
Net Charge0
Average Mass337.398
Monoisotopic Mass337.13076
SMILESCSCC[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O
InChIInChI=1S/C12H23N3O6S/c1-6(17)9(12(20)21)15-11(19)8(5-16)14-10(18)7(13)3-4-22-2/h6-9,16-17H,3-5,13H2,1-2H3,(H,14,18)(H,15,19)(H,20,21)/t6-,7+,8+,9+/m1/s1
InChIKeyDBMLDOWSVHMQQN-XGEHTFHBSA-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-Ser-Thr (CHEBI:161079) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxybutanoic acid