1. The absolute configuration of 1-epialexine hemihydrate.
- Author
-
Thompson AL, Watkin DJ, Gal ZA, Jones L, Hollinshead J, Jenkinson SF, Fleet GW, and Nash RJ
- Subjects
- Crystallography, X-Ray, Molecular Conformation, Pyrrolizidine Alkaloids chemistry
- Abstract
The absolute and relative configurations of 1-epialexine are established by X-ray crystallographic analysis, giving (1S,2R,3R,7S,7aS)-1,2,7-trihydroxy-3-(hydroxymethyl)pyrrolizidine. The compound crystallizes as the hemihydrate C(8)H(15)NO(4) x 0.5H(2)O, with hydrogen bonds holding the water molecule in a hydrophilic pocket between epialexine bilayers. In addition, a comparison was made between results obtained from examination of the Bijvoet pairs from data sets collected using molybdenum and copper radiation.
- Published
- 2008
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