Information card for entry 4035445

Structure parameters

• Formula: C40 H56 O10 Si
• Calculated formula: C40 H56 O10 Si
• SMILES: C1(=O)[C@]2(C[C@@]34CC[C@@]5(C(=O)[C@H]([C@@H]6[C@]7(C[C@H](C(=O)O7)C)O[C@]([C@H]56)([C@H]([C@@H]3CC[C@H]2[C@](C)(CO[Si](C)(C)C(C)(C)C)O1)OCc1ccccc1)O4)C)C)O.C1(=O)[C@@]2(C[C@]34CC[C@]5(C(=O)[C@@H]([C@H]6[C@@]7(C[C@@H](C(=O)O7)C)O[C@@]([C@@H]56)([C@@H]([C@H]3CC[C@@H]2[C@@](C)(CO[Si](C)(C)C(C)(C)C)O1)OCc1ccccc1)O4)C)C)O
• Title of publication: Asymmetric Total Synthesis of Lancifodilactone G Acetate. 2. Final Phase and Completion of the Total Synthesis.
• Authors of publication: Wang, Kuang-Yu; Liu, Dong-Dong; Sun, Tian-Wen; Lu, Yong; Zhang, Su-Lei; Li, Yuan-He; Han, Yi-Xin; Liu, Hao-Yuan; Peng, Cheng; Wang, Qin-Yang; Chen, Jia-Hua; Yang, Zhen
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2018
• Journal volume: 83
• Journal issue: 13
• Pages of publication: 6907 - 6923
• a: 8.538 ± 0.0005 Å
• b: 14.3233 ± 0.0009 Å
• c: 19.3139 ± 0.0012 Å
• α: 69.177 ± 0.006°
• β: 77.656 ± 0.005°
• γ: 85.101 ± 0.005°
• Cell volume: 2156.5 ± 0.2 ų
• Cell temperature: 180 ± 0.1 K
• Ambient diffraction temperature: 180 ± 0.1 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: 0.2379
• Residual factor for significantly intense reflections: 0.0971
• Weighted residual factors for significantly intense reflections: 0.1751
• Weighted residual factors for all reflections included in the refinement: 0.2499
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No