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CHEBI:158699 - Arg-Ala-Ile

Default Structure
ChEBI IDCHEBI:158699
ChEBI NameArg-Ala-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H30N6O4
Net Charge0
Average Mass358.443
Monoisotopic Mass358.23285
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)O
InChIInChI=1S/C15H30N6O4/c1-4-8(2)11(14(24)25)21-12(22)9(3)20-13(23)10(16)6-5-7-19-15(17)18/h8-11H,4-7,16H2,1-3H3,(H,20,23)(H,21,22)(H,24,25)(H4,17,18,19)/t8-,9-,10-,11-/m0/s1
InChIKeyPEFFAAKJGBZBKL-NAKRPEOUSA-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)
Arg-Ala-Ile (CHEBI:158699) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]propanoyl]amino]-3-methylpentanoic acid