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CHEBI:163281 - Glu-Thr-Ser

ChEBI IDCHEBI:163281
ChEBI NameGlu-Thr-Ser
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H21N3O8
Net Charge0
Average Mass335.313
Monoisotopic Mass335.13286
SMILESC[C@@H](O)[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O
InChIInChI=1S/C12H21N3O8/c1-5(17)9(11(21)14-7(4-16)12(22)23)15-10(20)6(13)2-3-8(18)19/h5-7,9,16-17H,2-4,13H2,1H3,(H,14,21)(H,15,20)(H,18,19)(H,22,23)/t5-,6+,7+,9+/m1/s1
InChIKeyMXJYXYDREQWUMS-XKBZYTNZSA-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)
Glu-Thr-Ser (CHEBI:163281) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-amino-5-[[(2S,3R)-1-[[(1S)-1-carboxy-2-hydroxyethyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-5-oxopentanoic acid