CHEBI:49339 - methyl L-phenylalaninate

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ChEBI Name methyl L-phenylalaninate
ChEBI ID CHEBI:49339
ChEBI ASCII Name methyl L-phenylalaninate
Definition An α-amino acid ester that is the methyl ester of L-phenylalanine.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C10H13NO2
Net Charge 0
Average Mass 179.21570
Monoisotopic Mass 179.09463
InChI InChI=1S/C10H13NO2/c1-13-10(12)9(11)7-8-5-3-2-4-6-8/h2-6,9H,7,11H2,1H3/t9-/m0/s1
InChIKey VSDUZFOSJDMAFZ-VIFPVBQESA-N
SMILES COC(=O)[C@@H](N)Cc1ccccc1
ChEBI Ontology
Outgoing methyl L-phenylalaninate (CHEBI:49339) is a α-amino acid ester (CHEBI:46874)
methyl L-phenylalaninate (CHEBI:49339) is a L-phenylalanine derivative (CHEBI:84144)
Incoming aspartame (CHEBI:2877) has functional parent methyl L-phenylalaninate (CHEBI:49339)
IUPAC Name
methyl L-phenylalaninate
Synonym Source
(S) -phenylalanine methyl ester ChEBI
Manual Xrefs Databases
0A9 PDBeChem
EP0278190 Patent
WO9820149 Patent
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Registry Numbers Types Sources
2212290 Reaxys Registry Number Reaxys
2577-90-4 CAS Registry Number ChemIDplus
Last Modified
07 January 2015