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CHEBI:164333 - His-Asp-Met

ChEBI IDCHEBI:164333
ChEBI NameHis-Asp-Met
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H23N5O6S
Net Charge0
Average Mass401.445
Monoisotopic Mass401.13690
SMILESCSCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1cncn1)C(=O)O
InChIInChI=1S/C15H23N5O6S/c1-27-3-2-10(15(25)26)19-14(24)11(5-12(21)22)20-13(23)9(16)4-8-6-17-7-18-8/h6-7,9-11H,2-5,16H2,1H3,(H,17,18)(H,19,24)(H,20,23)(H,21,22)(H,25,26)/t9-,10-,11-/m0/s1
InChIKeyWCNXUTNLSRWWQN-DCAQKATOSA-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-Asp-Met (CHEBI:164333) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-4-[[(1S)-1-carboxy-3-methylsulanylpropyl]amino]-4-oxobutanoic acid