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CHEBI:68527 - 3-ammonio-3-phenylpropanoate

ChEBI IDCHEBI:68527
ChEBI Name3-ammonio-3-phenylpropanoate
Stars
DefinitionAn amino-acid zwitterion arising form transfer of a proton from the carboxy to the amino group of 3-amino-3-phenylpropanoic acid; major species at pH 7.3.
Last Modified26 September 2012
SubmitterSteve
DownloadsMolfile
FormulaC9H11NO2
Net Charge0
Average Mass165.192
Monoisotopic Mass165.07898
SMILES[NH3+]C(CC(=O)[O-])c1ccccc1
InChIInChI=1S/C9H11NO2/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)
InChIKeyUJOYFRCOTPUKAK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-ammonio-3-phenylpropanoate (CHEBI:68527) is a amino-acid zwitterion (CHEBI:35238)
3-ammonio-3-phenylpropanoate (CHEBI:68527) is tautomer of 3-amino-3-phenylpropanoic acid (CHEBI:68528)
Incoming Relation(s)
(R)-3-ammonio-3-phenylpropanoate (CHEBI:67158) is a 3-ammonio-3-phenylpropanoate (CHEBI:68527)
(S)-3-ammonio-3-phenylpropanoate (CHEBI:68506) is a 3-ammonio-3-phenylpropanoate (CHEBI:68527)
3-amino-3-phenylpropanoic acid (CHEBI:68528) is tautomer of 3-ammonio-3-phenylpropanoate (CHEBI:68527)
IUPAC Name 
3-azaniumyl-3-phenylpropanoate
Synonyms  Source
β-phenylalanine zwitterionChEBI
3-amino-3-phenylpropanoic acid zwitterionChEBI