EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:162942 - Glu-His-Ala

ChEBI IDCHEBI:162942
ChEBI NameGlu-His-Ala
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H21N5O6
Net Charge0
Average Mass355.351
Monoisotopic Mass355.14918
SMILESC[C@H](NC(=O)[C@H](Cc1cncn1)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O
InChIInChI=1S/C14H21N5O6/c1-7(14(24)25)18-13(23)10(4-8-5-16-6-17-8)19-12(22)9(15)2-3-11(20)21/h5-7,9-10H,2-4,15H2,1H3,(H,16,17)(H,18,23)(H,19,22)(H,20,21)(H,24,25)/t7-,9-,10-/m0/s1
InChIKeyVXQOONWNIWFOCS-HGNGGELXSA-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)
Glu-His-Ala (CHEBI:162942) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-amino-5-[[(2S)-1-[[(1S)-1-carboxyethyl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid