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CHEBI:158227 - Ala-His-Met

ChEBI IDCHEBI:158227
ChEBI NameAla-His-Met
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H23N5O4S
Net Charge0
Average Mass357.436
Monoisotopic Mass357.14708
SMILESCSCC[C@H](NC(=O)[C@H](Cc1cncn1)NC(=O)[C@H](C)N)C(=O)O
InChIInChI=1S/C14H23N5O4S/c1-8(15)12(20)19-11(5-9-6-16-7-17-9)13(21)18-10(14(22)23)3-4-24-2/h6-8,10-11H,3-5,15H2,1-2H3,(H,16,17)(H,18,21)(H,19,20)(H,22,23)/t8-,10-,11-/m0/s1
InChIKeyAAXVGJXZKHQQHD-LSJOCFKGSA-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-His-Met (CHEBI:158227) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylsulanylbutanoic acid