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CHEBI:161243 - Phe-Ala-Ala

ChEBI IDCHEBI:161243
ChEBI NamePhe-Ala-Ala
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H21N3O4
Net Charge0
Average Mass307.350
Monoisotopic Mass307.15321
SMILESC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O
InChIInChI=1S/C15H21N3O4/c1-9(13(19)18-10(2)15(21)22)17-14(20)12(16)8-11-6-4-3-5-7-11/h3-7,9-10,12H,8,16H2,1-2H3,(H,17,20)(H,18,19)(H,21,22)/t9-,10-,12-/m0/s1
InChIKeyBJEYSVHMGIJORT-NHCYSSNCSA-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)
Phe-Ala-Ala (CHEBI:161243) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]propanoyl]amino]propanoic acid
Manual XrefsDatabases
57532722ChemSpider