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CHEBI:157828 - His-Met-Lys

ChEBI IDCHEBI:157828
ChEBI NameHis-Met-Lys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H30N6O4S
Net Charge0
Average Mass414.532
Monoisotopic Mass414.20492
SMILESCSCC[C@H](NC(=O)[C@@H](N)Cc1cncn1)C(=O)N[C@@H](CCCCN)C(=O)O
InChIInChI=1S/C17H30N6O4S/c1-28-7-5-13(16(25)23-14(17(26)27)4-2-3-6-18)22-15(24)12(19)8-11-9-20-10-21-11/h9-10,12-14H,2-8,18-19H2,1H3,(H,20,21)(H,22,24)(H,23,25)(H,26,27)/t12-,13-,14-/m0/s1
InChIKeyYYOCMTFVGKDNQP-IHRRRGAJSA-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-Met-Lys (CHEBI:157828) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylsulanylbutanoyl]amino]hexanoic acid
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