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CHEBI:160747 - Asp-Met-Ala

Default Structure
ChEBI IDCHEBI:160747
ChEBI NameAsp-Met-Ala
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H21N3O6S
Net Charge0
Average Mass335.382
Monoisotopic Mass335.11511
SMILESCSCC[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](C)C(=O)O
InChIInChI=1S/C12H21N3O6S/c1-6(12(20)21)14-11(19)8(3-4-22-2)15-10(18)7(13)5-9(16)17/h6-8H,3-5,13H2,1-2H3,(H,14,19)(H,15,18)(H,16,17)(H,20,21)/t6-,7-,8-/m0/s1
InChIKeySARSTIZOZFBDOM-FXQIFTODSA-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)
Asp-Met-Ala (CHEBI:160747) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S)-1-[[(1S)-1-carboxyethyl]amino]-4-methylsulanyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid