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CHEBI:164118 - Thr-Met-Ser

ChEBI IDCHEBI:164118
ChEBI NameThr-Met-Ser
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H23N3O6S
Net Charge0
Average Mass337.398
Monoisotopic Mass337.13076
SMILESCSCC[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O
InChIInChI=1S/C12H23N3O6S/c1-6(17)9(13)11(19)14-7(3-4-22-2)10(18)15-8(5-16)12(20)21/h6-9,16-17H,3-5,13H2,1-2H3,(H,14,19)(H,15,18)(H,20,21)/t6-,7+,8+,9+/m1/s1
InChIKeyWRUWXBBEFUTJOU-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)
Thr-Met-Ser (CHEBI:164118) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-4-methylsulanylbutanoyl]amino]-3-hydroxypropanoic acid