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CHEBI:163777 - Thr-Cys-Gln

ChEBI IDCHEBI:163777
ChEBI NameThr-Cys-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22N4O6S
Net Charge0
Average Mass350.397
Monoisotopic Mass350.12601
SMILESC[C@@H](O)[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C12H22N4O6S/c1-5(17)9(14)11(20)16-7(4-23)10(19)15-6(12(21)22)2-3-8(13)18/h5-7,9,17,23H,2-4,14H2,1H3,(H2,13,18)(H,15,19)(H,16,20)(H,21,22)/t5-,6+,7+,9+/m1/s1
InChIKeyUTCFSBBXPWKLTG-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)
Thr-Cys-Gln (CHEBI:163777) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2R)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-sulanylpropanoyl]amino]-5-oxopentanoic acid