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CHEBI:163283 - Glu-Thr-Thr

ChEBI IDCHEBI:163283
ChEBI NameGlu-Thr-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H23N3O8
Net Charge0
Average Mass349.340
Monoisotopic Mass349.14851
SMILESC[C@@H](O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)O
InChIInChI=1S/C13H23N3O8/c1-5(17)9(12(22)16-10(6(2)18)13(23)24)15-11(21)7(14)3-4-8(19)20/h5-7,9-10,17-18H,3-4,14H2,1-2H3,(H,15,21)(H,16,22)(H,19,20)(H,23,24)/t5-,6-,7+,9+,10+/m1/s1
InChIKeyCAQXJMUDOLSBPF-SUSMZKCASA-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-Thr (CHEBI:163283) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-amino-5-[[(2S,3R)-1-[[(1S,2R)-1-carboxy-2-hydroxypropyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-5-oxopentanoic acid