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CHEBI:162226 - Pro-Gln-Cys

ChEBI IDCHEBI:162226
ChEBI NamePro-Gln-Cys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H22N4O5S
Net Charge0
Average Mass346.409
Monoisotopic Mass346.13109
SMILESNC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)O
InChIInChI=1S/C13H22N4O5S/c14-10(18)4-3-8(12(20)17-9(6-23)13(21)22)16-11(19)7-2-1-5-15-7/h7-9,15,23H,1-6H2,(H2,14,18)(H,16,19)(H,17,20)(H,21,22)/t7-,8-,9-/m0/s1
InChIKeySNIPWBQKOPCJRG-CIUDSAMLSA-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)
Pro-Gln-Cys (CHEBI:162226) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2R)-2-[[(2S)-5-amino-5-oxo-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoyl]amino]-3-sulanylpropanoic acid