EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:161819 - Cys-Tyr-Val

ChEBI IDCHEBI:161819
ChEBI NameCys-Tyr-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H25N3O5S
Net Charge0
Average Mass383.470
Monoisotopic Mass383.15149
SMILESCC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CS)C(=O)O
InChIInChI=1S/C17H25N3O5S/c1-9(2)14(17(24)25)20-16(23)13(19-15(22)12(18)8-26)7-10-3-5-11(21)6-4-10/h3-6,9,12-14,21,26H,7-8,18H2,1-2H3,(H,19,22)(H,20,23)(H,24,25)/t12-,13-,14-/m0/s1
InChIKeyZOMMHASZJQRLFS-IHRRRGAJSA-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-Tyr-Val (CHEBI:161819) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoic acid