Information card for entry 7222458

Structure parameters

• Formula: C28 H47 O8.5
• Calculated formula: C28 H47 O8.5
• Title of publication: Capsisteroids A–F, Withanolides from the Leaves of Solanum capsicoides
• Authors of publication: Chen, Bo-Wei; Chen, Yih Yang; Lin, You-Cheng; Huang, Chiung-Yao; Chokkalingam, Uvarani; Hwang, Tsong-Long; Chiang, Michael, Y.; Liu, Ho-Yih; Sheu, Jyh-Horng
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 7.5227 ± 0.0004 Å
• b: 9.624 ± 0.0006 Å
• c: 37.396 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2707.4 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• 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: 0.0943
• Residual factor for significantly intense reflections: 0.0936
• Weighted residual factors for significantly intense reflections: 0.2351
• Weighted residual factors for all reflections included in the refinement: 0.2355
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No