EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:157847 - His-Phe-Ala

ChEBI IDCHEBI:157847
ChEBI NameHis-Phe-Ala
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H23N5O4
Net Charge0
Average Mass373.413
Monoisotopic Mass373.17500
SMILESC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1cncn1)C(=O)O
InChIInChI=1S/C18H23N5O4/c1-11(18(26)27)22-17(25)15(7-12-5-3-2-4-6-12)23-16(24)14(19)8-13-9-20-10-21-13/h2-6,9-11,14-15H,7-8,19H2,1H3,(H,20,21)(H,22,25)(H,23,24)(H,26,27)/t11-,14-,15-/m0/s1
InChIKeySAPLASXFNUYUFE-CQDKDKBSSA-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-Phe-Ala (CHEBI:157847) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-phenylpropanoyl]amino]propanoic acid