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CHEBI:159500 - Asn-Ala-Phe

ChEBI IDCHEBI:159500
ChEBI NameAsn-Ala-Phe
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H22N4O5
Net Charge0
Average Mass350.375
Monoisotopic Mass350.15902
SMILESC[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C16H22N4O5/c1-9(19-15(23)11(17)8-13(18)21)14(22)20-12(16(24)25)7-10-5-3-2-4-6-10/h2-6,9,11-12H,7-8,17H2,1H3,(H2,18,21)(H,19,23)(H,20,22)(H,24,25)/t9-,11-,12-/m0/s1
InChIKeyQQEWINYJRFBLNN-DLOVCJGASA-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-Phe (CHEBI:159500) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]propanoyl]amino]-3-phenylpropanoic acid