Information card for entry 4026242

Structure parameters

• Formula: C38 H58 O10
• Calculated formula: C38 H58 O10
• Title of publication: Total Synthesis of the G2/M DNA Damage Checkpoint Inhibitor Psilostachyin C
• Authors of publication: Chao Li; Shanghui Tu; Shuguang Wen; Shan Li; Junbiao Chang; Feng Shao; Xiaoguang Lei
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2011
• Journal volume: 76
• Pages of publication: 3566 - 3570
• a: 22.357 ± 0.005 Å
• b: 10.23 ± 0.002 Å
• c: 18.278 ± 0.004 Å
• α: 90°
• β: 116.86 ± 0.03°
• γ: 90°
• Cell volume: 3729.4 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0873
• Residual factor for significantly intense reflections: 0.0813
• Weighted residual factors for significantly intense reflections: 0.197
• Weighted residual factors for all reflections included in the refinement: 0.2015
• Goodness-of-fit parameter for all reflections included in the refinement: 1.22
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No