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CHEBI:158694 - Ile-Pro-Asn

ChEBI IDCHEBI:158694
ChEBI NameIle-Pro-Asn
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26N4O5
Net Charge0
Average Mass342.396
Monoisotopic Mass342.19032
SMILESCC[C@H](C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)O
InChIInChI=1S/C15H26N4O5/c1-3-8(2)12(17)14(22)19-6-4-5-10(19)13(21)18-9(15(23)24)7-11(16)20/h8-10,12H,3-7,17H2,1-2H3,(H2,16,20)(H,18,21)(H,23,24)/t8-,9-,10-,12-/m0/s1
InChIKeyXHBYEMIUENPZLY-GMOBBJLQSA-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-Pro-Asn (CHEBI:158694) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[(2S)-1-[(2S,3S)-2-amino-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoic acid
Manual XrefsDatabases
13164843ChemSpider