EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:165095 - Tyr-His-Cys

Default Structure
ChEBI IDCHEBI:165095
ChEBI NameTyr-His-Cys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H23N5O5S
Net Charge0
Average Mass421.479
Monoisotopic Mass421.14199
SMILESN[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1cncn1)C(=O)N[C@@H](CS)C(=O)O
InChIInChI=1S/C18H23N5O5S/c19-13(5-10-1-3-12(24)4-2-10)16(25)22-14(6-11-7-20-9-21-11)17(26)23-15(8-29)18(27)28/h1-4,7,9,13-15,24,29H,5-6,8,19H2,(H,20,21)(H,22,25)(H,23,26)(H,27,28)/t13-,14-,15-/m0/s1
InChIKeyOHNXAUCZVWGTLL-KKUMJFAQSA-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-His-Cys (CHEBI:165095) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2R)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-sulanylpropanoic acid