Acta Crystallographica Section E (Dec 2013)

2-Methylaspartic acid monohydrate

  • Ray J. Butcher,
  • Jason P. Dworkin,
  • Aaron S. Burton,
  • Greg Brewer

DOI
https://doi.org/10.1107/S1600536813032170
Journal volume & issue
Vol. 69, no. 12
pp. o1856 – o1857

Abstract

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The title compound, C5H9NO4·H2O, is an isomer of the α-amino acid glutamic acid that crystallizes from water in its zwitterionic form as a monohydrate. It is not one of the 20 proteinogenic α-amino acids that are used in living systems and differs from the natural amino acids in that it has an α-methyl group rather than an α-H atom. In the crystal, an O—H...O hydrogen bond is present between the acid and water molecules while extensive N—H...O and O—H...O hydrogen bonds link the components into a three-dimensional array.