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CHEBI:158373 - Ala-Met-Gln

Default Structure
ChEBI IDCHEBI:158373
ChEBI NameAla-Met-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H24N4O5S
Net Charge0
Average Mass348.425
Monoisotopic Mass348.14674
SMILESCSCC[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C13H24N4O5S/c1-7(14)11(19)16-8(5-6-23-2)12(20)17-9(13(21)22)3-4-10(15)18/h7-9H,3-6,14H2,1-2H3,(H2,15,18)(H,16,19)(H,17,20)(H,21,22)/t7-,8-,9-/m0/s1
InChIKeyPVQLRJRPUTXFFX-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)
Ala-Met-Gln (CHEBI:158373) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-4-methylsulanylbutanoyl]amino]-5-oxopentanoic acid