EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:160786 - Met-His-Leu

ChEBI IDCHEBI:160786
ChEBI NameMet-His-Leu
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H29N5O4S
Net Charge0
Average Mass399.517
Monoisotopic Mass399.19403
SMILESCSCC[C@H](N)C(=O)N[C@@H](Cc1cncn1)C(=O)N[C@@H](CC(C)C)C(=O)O
InChIInChI=1S/C17H29N5O4S/c1-10(2)6-14(17(25)26)22-16(24)13(7-11-8-19-9-20-11)21-15(23)12(18)4-5-27-3/h8-10,12-14H,4-7,18H2,1-3H3,(H,19,20)(H,21,23)(H,22,24)(H,25,26)/t12-,13-,14-/m0/s1
InChIKeyTZHFJXDKXGZHEN-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)
Met-His-Leu (CHEBI:160786) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoic acid