Information card for entry 4023355

Structure parameters

• Formula: C17 H23 N O5
• Calculated formula: C17 H23 N O5
• SMILES: N1C(=O)[C@@](O)(C)[C@H](O)[C@]21[C@H](C(C)C)O[C@@H](OC2)c1ccccc1
• Title of publication: Enantioselective Total Syntheses of Omuralide, 7-epi-Omuralide, and (+)-Lactacystin
• Authors of publication: Christopher J. Hayes; Alexandra E. Sherlock; Martin P. Green; Claire Wilson; Alexander J. Blake; Matthew D. Selby; Jeremy C. Prodger
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2008
• Journal volume: 73
• Pages of publication: 2041 - 2051
• a: 6.0582 ± 0.0003 Å
• b: 13.239 ± 0.0006 Å
• c: 20.3127 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1629.17 ± 0.13 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 4
• 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: 0.0274
• Residual factor for significantly intense reflections: 0.0265
• Weighted residual factors for significantly intense reflections: 0.0684
• Weighted residual factors for all reflections included in the refinement: 0.0689
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No