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CHEBI:158528 - Ile-Ile-Val

ChEBI IDCHEBI:158528
ChEBI NameIle-Ile-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H33N3O4
Net Charge0
Average Mass343.468
Monoisotopic Mass343.24711
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC
InChIInChI=1S/C17H33N3O4/c1-7-10(5)12(18)15(21)20-14(11(6)8-2)16(22)19-13(9(3)4)17(23)24/h9-14H,7-8,18H2,1-6H3,(H,19,22)(H,20,21)(H,23,24)/t10-,11-,12-,13-,14-/m0/s1
InChIKeyQZZIBQZLWBOOJH-PEDHHIEDSA-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-Ile-Val (CHEBI:158528) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoic acid