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CHEBI:161064 - Asp-Val-Val

ChEBI IDCHEBI:161064
ChEBI NameAsp-Val-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H25N3O6
Net Charge0
Average Mass331.369
Monoisotopic Mass331.17434
SMILESCC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)O
InChIInChI=1S/C14H25N3O6/c1-6(2)10(16-12(20)8(15)5-9(18)19)13(21)17-11(7(3)4)14(22)23/h6-8,10-11H,5,15H2,1-4H3,(H,16,20)(H,17,21)(H,18,19)(H,22,23)/t8-,10-,11-/m0/s1
InChIKeyZUNMTUPRQMWMHX-LSJOCFKGSA-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-Val (CHEBI:161064) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoic acid