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CHEBI:159693 - Asn-Gln-Ile

ChEBI IDCHEBI:159693
ChEBI NameAsn-Gln-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H27N5O6
Net Charge0
Average Mass373.410
Monoisotopic Mass373.19613
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(N)=O)C(=O)O
InChIInChI=1S/C15H27N5O6/c1-3-7(2)12(15(25)26)20-14(24)9(4-5-10(17)21)19-13(23)8(16)6-11(18)22/h7-9,12H,3-6,16H2,1-2H3,(H2,17,21)(H2,18,22)(H,19,23)(H,20,24)(H,25,26)/t7-,8-,9-,12-/m0/s1
InChIKeyUPALZCBCKAMGIY-PEFMBERDSA-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)
Asn-Gln-Ile (CHEBI:159693) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoic acid