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CHEBI:157921 - Ala-Ala-His

ChEBI IDCHEBI:157921
ChEBI NameAla-Ala-His
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H19N5O4
Net Charge0
Average Mass297.315
Monoisotopic Mass297.14370
SMILESC[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cncn1)C(=O)O
InChIInChI=1S/C12H19N5O4/c1-6(13)10(18)16-7(2)11(19)17-9(12(20)21)3-8-4-14-5-15-8/h4-7,9H,3,13H2,1-2H3,(H,14,15)(H,16,18)(H,17,19)(H,20,21)/t6-,7-,9-/m0/s1
InChIKeyWQVFQXXBNHHPLX-ZKWXMUAHSA-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-Ala-His (CHEBI:157921) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid