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CHEBI:161419 - Cys-His-Val

ChEBI IDCHEBI:161419
ChEBI NameCys-His-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H23N5O4S
Net Charge0
Average Mass357.436
Monoisotopic Mass357.14708
SMILESCC(C)[C@H](NC(=O)[C@H](Cc1cncn1)NC(=O)[C@@H](N)CS)C(=O)O
InChIInChI=1S/C14H23N5O4S/c1-7(2)11(14(22)23)19-13(21)10(3-8-4-16-6-17-8)18-12(20)9(15)5-24/h4,6-7,9-11,24H,3,5,15H2,1-2H3,(H,16,17)(H,18,20)(H,19,21)(H,22,23)/t9-,10-,11-/m0/s1
InChIKeyPJWIPBIMSKJTIE-DCAQKATOSA-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-His-Val (CHEBI:161419) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-methylbutanoic acid