Information card for entry 4102482

Structure parameters

• Formula: C32 H30 O8
• Calculated formula: C32 H30 O8
• SMILES: Oc1cc2c([C@@](c3cc(OC)cc(OC)c3)(C(=O)O[C@@H]2Cc2ccc(OC)cc2)c2ccc(OC)cc2)c(O)c1
• Title of publication: Total Synthesis and Biological Evaluation of the Resveratrol-Derived Polyphenol Natural Products Hopeanol and Hopeahainol A
• Authors of publication: K. C. Nicolaou; Qiang Kang; T. Robert Wu; Chek Shik Lim; David Y.-K. Chen
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 7540 - 7548
• a: 9.2753 ± 0.0019 Å
• b: 15.671 ± 0.003 Å
• c: 17.772 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2583.2 ± 0.9 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 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: 0.0527
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1273
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No