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CHEBI:164352 - His-Cys-Asn

ChEBI IDCHEBI:164352
ChEBI NameHis-Cys-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H20N6O5S
Net Charge0
Average Mass372.407
Monoisotopic Mass372.12159
SMILESNC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1cncn1)C(=O)O
InChIInChI=1S/C13H20N6O5S/c14-7(1-6-3-16-5-17-6)11(21)19-9(4-25)12(22)18-8(13(23)24)2-10(15)20/h3,5,7-9,25H,1-2,4,14H2,(H2,15,20)(H,16,17)(H,18,22)(H,19,21)(H,23,24)/t7-,8-,9-/m0/s1
InChIKeyRBOOOLVEKJHUNA-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)
His-Cys-Asn (CHEBI:164352) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[(2R)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-sulanylpropanoyl]amino]-4-oxobutanoic acid