Information card for entry 7231509

Structure parameters

• Formula: C20 H28 O6
• Calculated formula: C20 H28 O6
• Title of publication: Polyellisin, a novel polyketide from cultures of the basidiomycete Polyporus ellisii
• Authors of publication: Wang, Shuang; Li, Zheng-Hui; Ai, Hong-Lian; He, Juan; Feng, Tao; Liu, Ji-Kai
• Journal of publication: RSC Advances
• Year of publication: 2018
• Journal volume: 8
• Journal issue: 55
• Pages of publication: 31538
• a: 7.6565 ± 0.0002 Å
• b: 9.8198 ± 0.0003 Å
• c: 24.8755 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1870.27 ± 0.09 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: 0.0313
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.079
• Weighted residual factors for all reflections included in the refinement: 0.0792
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No