Information card for entry 1549010

Structure parameters

• Formula: C41 H64 O9
• Calculated formula: C41 H64 O9
• Title of publication: Structurally Diverse Diterpenoids from Sandwithia guyanensis
• Authors of publication: Remy, Simon; Olivon, Florent; Desrat, Sandy; Blanchard, Florent; Eparvier, Véronique; Leyssen, Pieter; Neyts, Johan; Roussi, Fanny; Touboul, David; Litaudon, Marc
• Journal of publication: Journal of Natural Products
• Year of publication: 2018
• a: 7.8136 ± 0.0004 Å
• b: 22.8068 ± 0.0011 Å
• c: 65.613 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11692.4 ± 1.2 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 3
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for all reflections: 0.1997
• Residual factor for significantly intense reflections: 0.0795
• Weighted residual factors for significantly intense reflections: 0.1422
• Weighted residual factors for all reflections included in the refinement: 0.1907
• Goodness-of-fit parameter for all reflections included in the refinement: 0.944
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No