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CHEBI:162387 - Pro-Ile-Gln

ChEBI IDCHEBI:162387
ChEBI NamePro-Ile-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H28N4O5
Net Charge0
Average Mass356.423
Monoisotopic Mass356.20597
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C16H28N4O5/c1-3-9(2)13(20-14(22)10-5-4-8-18-10)15(23)19-11(16(24)25)6-7-12(17)21/h9-11,13,18H,3-8H2,1-2H3,(H2,17,21)(H,19,23)(H,20,22)(H,24,25)/t9-,10-,11-,13-/m0/s1
InChIKeyBWCZJGJKOFUUCN-ZPFDUUQYSA-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)
Pro-Ile-Gln (CHEBI:162387) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S,3S)-3-methyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoyl]amino]-5-oxopentanoic acid