CHEBI:161878 - Gln-Ala-Ile

ChEBI IDCHEBI:161878
ChEBI NameGln-Ala-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H26N4O5
Net Charge0
Average Mass330.385
Monoisotopic Mass330.19032
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O
InChIInChI=1S/C14H26N4O5/c1-4-7(2)11(14(22)23)18-12(20)8(3)17-13(21)9(15)5-6-10(16)19/h7-9,11H,4-6,15H2,1-3H3,(H2,16,19)(H,17,21)(H,18,20)(H,22,23)/t7-,8-,9-,11-/m0/s1
InChIKeyLKUWAWGNJYJODH-KBIXCLLPSA-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)
Gln-Ala-Ile (CHEBI:161878) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]propanoyl]amino]-3-methylpentanoic acid