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CHEBI:158889 - Ile-Val-Ala

ChEBI IDCHEBI:158889
ChEBI NameIle-Val-Ala
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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(=O)N[C@@H](C)C(=O)O)C(C)C
InChIInChI=1S/C14H27N3O4/c1-6-8(4)10(15)12(18)17-11(7(2)3)13(19)16-9(5)14(20)21/h7-11H,6,15H2,1-5H3,(H,16,19)(H,17,18)(H,20,21)/t8-,9-,10-,11-/m0/s1
InChIKeyYJRSIJZUIUANHO-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-Val-Ala (CHEBI:158889) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylbutanoyl]amino]propanoic acid