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CHEBI:157816 - His-Met-Gln

ChEBI IDCHEBI:157816
ChEBI NameHis-Met-Gln
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H26N6O5S
Net Charge0
Average Mass414.488
Monoisotopic Mass414.16854
SMILESCSCC[C@H](NC(=O)[C@@H](N)Cc1cncn1)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C16H26N6O5S/c1-28-5-4-11(15(25)22-12(16(26)27)2-3-13(18)23)21-14(24)10(17)6-9-7-19-8-20-9/h7-8,10-12H,2-6,17H2,1H3,(H2,18,23)(H,19,20)(H,21,24)(H,22,25)(H,26,27)/t10-,11-,12-/m0/s1
InChIKeyNKRWVZQTPXPNRZ-SRVKXCTJSA-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-Gln (CHEBI:157816) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylsulanylbutanoyl]amino]-5-oxopentanoic acid