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CHEBI:158165 - Ile-Ala-Val

ChEBI IDCHEBI:158165
ChEBI NameIle-Ala-Val
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H27N3O4
Net Charge0
Average Mass301.387
Monoisotopic Mass301.20016
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C
InChIInChI=1S/C14H27N3O4/c1-6-8(4)10(15)13(19)16-9(5)12(18)17-11(7(2)3)14(20)21/h7-11H,6,15H2,1-5H3,(H,16,19)(H,17,18)(H,20,21)/t8-,9-,10-,11-/m0/s1
InChIKeyMKWSZEHGHSLNPF-NAKRPEOUSA-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)
Ile-Ala-Val (CHEBI:158165) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]propanoyl]amino]-3-methylbutanoic acid