EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:162078 - Pro-Arg-Ile

ChEBI IDCHEBI:162078
ChEBI NamePro-Arg-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H32N6O4
Net Charge0
Average Mass384.481
Monoisotopic Mass384.24850
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1)C(=O)O
InChIInChI=1S/C17H32N6O4/c1-3-10(2)13(16(26)27)23-15(25)12(7-5-9-21-17(18)19)22-14(24)11-6-4-8-20-11/h10-13,20H,3-9H2,1-2H3,(H,22,24)(H,23,25)(H,26,27)(H4,18,19,21)/t10-,11-,12-,13-/m0/s1
InChIKeyGRIRJQGZZJVANI-CYDGBPFRSA-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-Arg-Ile (CHEBI:162078) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoyl]amino]-3-methylpentanoic acid