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CHEBI:158266 - Ile-Asp-Ile

ChEBI IDCHEBI:158266
ChEBI NameIle-Asp-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H29N3O6
Net Charge0
Average Mass359.423
Monoisotopic Mass359.20564
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)CC
InChIInChI=1S/C16H29N3O6/c1-5-8(3)12(17)15(23)18-10(7-11(20)21)14(22)19-13(16(24)25)9(4)6-2/h8-10,12-13H,5-7,17H2,1-4H3,(H,18,23)(H,19,22)(H,20,21)(H,24,25)/t8-,9-,10-,12-,13-/m0/s1
InChIKeyBGZIJZJBXRVBGJ-SXTJYALSSA-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-Asp-Ile (CHEBI:158266) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-carboxypropanoyl]amino]-3-methylpentanoic acid