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CHEBI:158042 - Ala-Asp-Met

ChEBI IDCHEBI:158042
ChEBI NameAla-Asp-Met
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Last Modified20 March 2025
SubmitterMetaboLights
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FormulaC12H21N3O6S
Net Charge0
Average Mass335.382
Monoisotopic Mass335.11511
SMILESCSCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)N)C(=O)O
InChIInChI=1S/C12H21N3O6S/c1-6(13)10(18)15-8(5-9(16)17)11(19)14-7(12(20)21)3-4-22-2/h6-8H,3-5,13H2,1-2H3,(H,14,19)(H,15,18)(H,16,17)(H,20,21)/t6-,7-,8-/m0/s1
InChIKeyFOWHQTWRLFTELJ-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)
Ala-Asp-Met (CHEBI:158042) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-[[(2S)-2-aminopropanoyl]amino]-4-[[(1S)-1-carboxy-3-methylsulanylpropyl]amino]-4-oxobutanoic acid