EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:163964 - Thr-His-Tyr

ChEBI IDCHEBI:163964
ChEBI NameThr-His-Tyr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H25N5O6
Net Charge0
Average Mass419.438
Monoisotopic Mass419.18048
SMILESC[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1cncn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C19H25N5O6/c1-10(25)16(20)18(28)23-14(7-12-8-21-9-22-12)17(27)24-15(19(29)30)6-11-2-4-13(26)5-3-11/h2-5,8-10,14-16,25-26H,6-7,20H2,1H3,(H,21,22)(H,23,28)(H,24,27)(H,29,30)/t10-,14+,15+,16+/m1/s1
InChIKeyYDWLCDQXLCILCZ-BWAGICSOSA-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)
Thr-His-Tyr (CHEBI:163964) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid