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CHEBI:158108 - Ala-Gln-His

ChEBI IDCHEBI:158108
ChEBI NameAla-Gln-His
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H22N6O5
Net Charge0
Average Mass354.367
Monoisotopic Mass354.16517
SMILESC[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1cncn1)C(=O)O
InChIInChI=1S/C14H22N6O5/c1-7(15)12(22)19-9(2-3-11(16)21)13(23)20-10(14(24)25)4-8-5-17-6-18-8/h5-7,9-10H,2-4,15H2,1H3,(H2,16,21)(H,17,18)(H,19,22)(H,20,23)(H,24,25)/t7-,9-,10-/m0/s1
InChIKeyOQCPATDFWYYDDX-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)
Ala-Gln-His (CHEBI:158108) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-aminopropanoyl]amino]-5-oxopentanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid