Information card for entry 1508287

Structure parameters

• Formula: C37 H47 N O7
• Calculated formula: C37 H47 N O7
• SMILES: c1ccccc1CO[C@@H]1CCC2(C[C@H]1[C@H]([C@@H](Cc1ccc(cc1)OC)NC(=O)OC(C)(C)C)OCc1ccccc1)OCCO2.c1ccccc1CO[C@H]1CCC2(C[C@@H]1[C@@H]([C@H](Cc1ccc(cc1)OC)NC(=O)OC(C)(C)C)OCc1ccccc1)OCCO2
• Title of publication: Total synthesis of (-)-FR901483.
• Authors of publication: Ma, Ai-Jun; Tu, Yong-Qiang; Peng, Jin-Bao; Dou, Qing-Yun; Hou, Si-Hua; Zhang, Fu-Min; Wang, Shao-Hua
• Journal of publication: Organic letters
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 14
• Pages of publication: 3604 - 3607
• a: 8.472 ± 0.011 Å
• b: 14.485 ± 0.018 Å
• c: 15.543 ± 0.02 Å
• α: 68.44 ± 0.011°
• β: 79.441 ± 0.013°
• γ: 74.597 ± 0.012°
• Cell volume: 1702 ± 4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1418
• Residual factor for significantly intense reflections: 0.0666
• Weighted residual factors for significantly intense reflections: 0.17
• Weighted residual factors for all reflections included in the refinement: 0.2246
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No