EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:166165 - Val-Gln-Met

ChEBI IDCHEBI:166165
ChEBI NameVal-Gln-Met
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H28N4O5S
Net Charge0
Average Mass376.479
Monoisotopic Mass376.17804
SMILESCSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)C(C)C)C(=O)O
InChIInChI=1S/C15H28N4O5S/c1-8(2)12(17)14(22)18-9(4-5-11(16)20)13(21)19-10(15(23)24)6-7-25-3/h8-10,12H,4-7,17H2,1-3H3,(H2,16,20)(H,18,22)(H,19,21)(H,23,24)/t9-,10-,12-/m0/s1
InChIKeyPGBJAZDAEWPDAA-NHCYSSNCSA-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)
Val-Gln-Met (CHEBI:166165) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-5-oxopentanoyl]amino]-4-methylsulanylbutanoic acid