Information card for entry 4108939

Structure parameters

• Common name: drsenone
• Chemical name: (4a<i>S</i>,8a<i>S</i>,9<i>S</i>)-3-(Benzyloxy)-4a-(<i>tert</i>- butyldimethylsilyloxy)-9-(dimethylamino)-8a,9- dihydronaphtho[2,3-<i>d</i>]isoxazole-4,5(4a<i>H</i>,8<i>H</i>)-dione
• Formula: C26 H34 N2 O5 Si
• Calculated formula: C26 H34 N2 O5 Si
• Title of publication: A Robust Platform for the Synthesis of New Tetracycline Antibiotics
• Authors of publication: Cuixiang Sun; Qiu Wang; Jason D. Brubaker; Peter M. Wright; Christian D. Lerner; Kevin Noson; Mark Charest; Dionicio R. Siegel; Yi-Ming Wang; Andrew G. Myers
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 17913 - 17927
• a: 8.7457 ± 0.0007 Å
• b: 9.5756 ± 0.0007 Å
• c: 31.598 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2646.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0851
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.0961
• Weighted residual factors for all reflections included in the refinement: 0.1077
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No