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CHEBI:161041 - Asp-Val-Gly

ChEBI IDCHEBI:161041
ChEBI NameAsp-Val-Gly
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H19N3O6
Net Charge0
Average Mass289.288
Monoisotopic Mass289.12739
SMILESCC(C)[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)O
InChIInChI=1S/C11H19N3O6/c1-5(2)9(11(20)13-4-8(17)18)14-10(19)6(12)3-7(15)16/h5-6,9H,3-4,12H2,1-2H3,(H,13,20)(H,14,19)(H,15,16)(H,17,18)/t6-,9-/m0/s1
InChIKeyXWKPSMRPIKKDDU-RCOVLWMOSA-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-Val-Gly (CHEBI:161041) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S)-1-(carboxymethylamino)-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid