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CHEBI:163807 - Thr-Gln-Ala

ChEBI IDCHEBI:163807
ChEBI NameThr-Gln-Ala
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22N4O6
Net Charge0
Average Mass318.330
Monoisotopic Mass318.15393
SMILESC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O
InChIInChI=1S/C12H22N4O6/c1-5(12(21)22)15-10(19)7(3-4-8(13)18)16-11(20)9(14)6(2)17/h5-7,9,17H,3-4,14H2,1-2H3,(H2,13,18)(H,15,19)(H,16,20)(H,21,22)/t5-,6+,7-,9-/m0/s1
InChIKeyOYTNZCBFDXGQGE-XQXXSGGOSA-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-Gln-Ala (CHEBI:163807) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-5-amino-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-5-oxopentanoyl]amino]propanoic acid