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CHEBI:158679 - Ala-Val-Val

ChEBI IDCHEBI:158679
ChEBI NameAla-Val-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H25N3O4
Net Charge0
Average Mass287.360
Monoisotopic Mass287.18451
SMILESCC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)O
InChIInChI=1S/C13H25N3O4/c1-6(2)9(15-11(17)8(5)14)12(18)16-10(7(3)4)13(19)20/h6-10H,14H2,1-5H3,(H,15,17)(H,16,18)(H,19,20)/t8-,9-,10-/m0/s1
InChIKeyBJFKXBOBGVWFCT-GUBZILKMSA-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-Val-Val (CHEBI:158679) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoic acid