MEA

N-METHYLPHENYLALANINE

Created: 2002-06-19
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count26
Chiral Atom Count1
Bond Count26
Aromatic Bond Count6
2D diagram of MEA

Chemical Component Summary

NameN-METHYLPHENYLALANINE
Systematic Name (OpenEye OEToolkits)(2S)-2-(methylamino)-3-phenyl-propanoic acid
FormulaC10 H13 N O2
Molecular Weight179.216
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=C(O)C(NC)Cc1ccccc1
SMILESCACTVS3.370CN[CH](Cc1ccccc1)C(O)=O
SMILESOpenEye OEToolkits1.7.0CNC(Cc1ccccc1)C(=O)O
Canonical SMILESCACTVS3.370 CN[C@@H](Cc1ccccc1)C(O)=O
Canonical SMILESOpenEye OEToolkits1.7.0 CN[C@@H](Cc1ccccc1)C(=O)O
InChIInChI1.03 InChI=1S/C10H13NO2/c1-11-9(10(12)13)7-8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3,(H,12,13)/t9-/m0/s1
InChIKeyInChI1.03 SCIFESDRCALIIM-VIFPVBQESA-N

Related Resource References

Resource NameReference
PubChem 6951134, 6951135
ChEMBL CHEMBL1234265
ChEBI CHEBI:43980, CHEBI:61883