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CHEBI:161710 - Cys-Thr-Gln

ChEBI IDCHEBI:161710
ChEBI NameCys-Thr-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22N4O6S
Net Charge0
Average Mass350.397
Monoisotopic Mass350.12601
SMILESC[C@@H](O)[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C12H22N4O6S/c1-5(17)9(16-10(19)6(13)4-23)11(20)15-7(12(21)22)2-3-8(14)18/h5-7,9,17,23H,2-4,13H2,1H3,(H2,14,18)(H,15,20)(H,16,19)(H,21,22)/t5-,6+,7+,9+/m1/s1
InChIKeyMWVDDZUTWXFYHL-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)
Cys-Thr-Gln (CHEBI:161710) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S,3R)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-3-hydroxybutanoyl]amino]-5-oxopentanoic acid