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CHEBI:159496 - Asn-Ala-Lys

ChEBI IDCHEBI:159496
ChEBI NameAsn-Ala-Lys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H25N5O5
Net Charge0
Average Mass331.373
Monoisotopic Mass331.18557
SMILESC[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O
InChIInChI=1S/C13H25N5O5/c1-7(17-12(21)8(15)6-10(16)19)11(20)18-9(13(22)23)4-2-3-5-14/h7-9H,2-6,14-15H2,1H3,(H2,16,19)(H,17,21)(H,18,20)(H,22,23)/t7-,8-,9-/m0/s1
InChIKeySLKLLQWZQHXYSV-CIUDSAMLSA-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-Ala-Lys (CHEBI:159496) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-6-amino-2-[[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]propanoyl]amino]hexanoic acid
Manual XrefsDatabases
9419466ChemSpider