EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:166039 - Tyr-Val-Cys

ChEBI IDCHEBI:166039
ChEBI NameTyr-Val-Cys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H25N3O5S
Net Charge0
Average Mass383.470
Monoisotopic Mass383.15149
SMILESCC(C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)O
InChIInChI=1S/C17H25N3O5S/c1-9(2)14(16(23)19-13(8-26)17(24)25)20-15(22)12(18)7-10-3-5-11(21)6-4-10/h3-6,9,12-14,21,26H,7-8,18H2,1-2H3,(H,19,23)(H,20,22)(H,24,25)/t12-,13-,14-/m0/s1
InChIKeyBQASAMYRHNCKQE-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)
Tyr-Val-Cys (CHEBI:166039) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2R)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]-3-sulanylpropanoic acid