Information card for entry 7150263

Structure parameters

• Formula: C35 H44 O10 Si
• Calculated formula: C35 H44 O10 Si
• SMILES: [Si](c1occc1[C@]1(O)[C@@H](OCc2ccc(OC)cc2)[C@H](OC(=O)[C@@H](OC(=O)C)c2ccccc2)[C@H](C[C@H]1C(=O)OCC)C)(C)(C)C
• Title of publication: A total synthesis of milbemycin G: approaches to the C1-C10-fragment and completion of the synthesis.
• Authors of publication: Bailey, Simon; Helliwell, Madeleine; Teerawutgulrag, Aphiwat; Thomas, Eric J.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2005
• Journal volume: 3
• Journal issue: 20
• Pages of publication: 3654 - 3677
• a: 14.792 ± 0.002 Å
• b: 28.3 ± 0.004 Å
• c: 8.5666 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3586.1 ± 0.8 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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 significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.0602
• Goodness-of-fit parameter for significantly intense reflections: 2.173
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No