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CHEBI:160576 - Met-Asp-Gln

ChEBI IDCHEBI:160576
ChEBI NameMet-Asp-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H24N4O7S
Net Charge0
Average Mass392.434
Monoisotopic Mass392.13657
SMILESCSCC[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C14H24N4O7S/c1-26-5-4-7(15)12(22)18-9(6-11(20)21)13(23)17-8(14(24)25)2-3-10(16)19/h7-9H,2-6,15H2,1H3,(H2,16,19)(H,17,23)(H,18,22)(H,20,21)(H,24,25)/t7-,8-,9-/m0/s1
InChIKeyJQECLVNLAZGHRQ-CIUDSAMLSA-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-Asp-Gln (CHEBI:160576) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-carboxypropanoyl]amino]-5-oxopentanoic acid