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CHEBI:158236 - Ile-Asn-Pro

Default Structure
ChEBI IDCHEBI:158236
ChEBI NameIle-Asn-Pro
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26N4O5
Net Charge0
Average Mass342.396
Monoisotopic Mass342.19032
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@@H]1C(=O)O
InChIInChI=1S/C15H26N4O5/c1-3-8(2)12(17)13(21)18-9(7-11(16)20)14(22)19-6-4-5-10(19)15(23)24/h8-10,12H,3-7,17H2,1-2H3,(H2,16,20)(H,18,21)(H,23,24)/t8-,9-,10+,12-/m0/s1
InChIKeyUKTUOMWSJPXODT-GUDRVLHUSA-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-Asn-Pro (CHEBI:158236) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2R)-1-[(2S)-4-amino-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-oxobutanoyl]pyrrolidine-2-carboxylic acid