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CHEBI:162181 - Pro-Cys-Asn

ChEBI IDCHEBI:162181
ChEBI NamePro-Cys-Asn
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H20N4O5S
Net Charge0
Average Mass332.382
Monoisotopic Mass332.11544
SMILESNC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)O
InChIInChI=1S/C12H20N4O5S/c13-9(17)4-7(12(20)21)15-11(19)8(5-22)16-10(18)6-2-1-3-14-6/h6-8,14,22H,1-5H2,(H2,13,17)(H,15,19)(H,16,18)(H,20,21)/t6-,7-,8-/m0/s1
InChIKeyLUGOKRWYNMDGTD-FXQIFTODSA-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-Cys-Asn (CHEBI:162181) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-4-oxo-2-[[(2R)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]-3-sulanylpropanoyl]amino]butanoic acid