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CHEBI:158500 - Ile-Ile-Gln

ChEBI IDCHEBI:158500
ChEBI NameIle-Ile-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H32N4O5
Net Charge0
Average Mass372.466
Monoisotopic Mass372.23727
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)CC
InChIInChI=1S/C17H32N4O5/c1-5-9(3)13(19)15(23)21-14(10(4)6-2)16(24)20-11(17(25)26)7-8-12(18)22/h9-11,13-14H,5-8,19H2,1-4H3,(H2,18,22)(H,20,24)(H,21,23)(H,25,26)/t9-,10-,11-,13-,14-/m0/s1
InChIKeyRIVKTKFVWXRNSJ-GRLWGSQLSA-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-Gln (CHEBI:158500) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S,3S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylpentanoyl]amino]-5-oxopentanoic acid