EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:163951 - Thr-His-Met

ChEBI IDCHEBI:163951
ChEBI NameThr-His-Met
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H25N5O5S
Net Charge0
Average Mass387.462
Monoisotopic Mass387.15764
SMILESCSCC[C@H](NC(=O)[C@H](Cc1cncn1)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O
InChIInChI=1S/C15H25N5O5S/c1-8(21)12(16)14(23)20-11(5-9-6-17-7-18-9)13(22)19-10(15(24)25)3-4-26-2/h6-8,10-12,21H,3-5,16H2,1-2H3,(H,17,18)(H,19,22)(H,20,23)(H,24,25)/t8-,10+,11+,12+/m1/s1
InChIKeyKLCCPYZXGXHAGS-QTKMDUPCSA-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)
Thr-His-Met (CHEBI:163951) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylsulanylbutanoic acid