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CHEBI:158003 - His-Thr-Tyr

ChEBI IDCHEBI:158003
ChEBI NameHis-Thr-Tyr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H25N5O6
Net Charge0
Average Mass419.438
Monoisotopic Mass419.18048
SMILESC[C@@H](O)[C@H](NC(=O)[C@@H](N)Cc1cncn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C19H25N5O6/c1-10(25)16(24-17(27)14(20)7-12-8-21-9-22-12)18(28)23-15(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
InChIKeyDEMIXZCKUXVEBO-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)
His-Thr-Tyr (CHEBI:158003) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3R)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid