Information card for entry 1566290

Structure parameters

• Formula: C32 H34 O12
• Calculated formula: C32 H34 O12
• SMILES: O1c2cc(c(c(O)c2C(=O)C[C@@]1([C@H]1OC(=O)C[C@@H]1OC)C)c1c(O)c2c(O[C@](CC2=O)([C@H]2OC(=O)C[C@@H]2OC)C)cc1C)C
• Title of publication: Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>.
• Authors of publication: Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao
• Journal of publication: Journal of natural products
• Year of publication: 2022
• Journal volume: 85
• Journal issue: 1
• Pages of publication: 148 - 161
• a: 7.9321 ± 0.0001 Å
• b: 10.0348 ± 0.0001 Å
• c: 18.6923 ± 0.0002 Å
• α: 90°
• β: 91.815 ± 0.001°
• γ: 90°
• Cell volume: 1487.11 ± 0.03 ų
• Cell temperature: 100.1 ± 0.2 K
• Ambient diffraction temperature: 100.1 ± 0.2 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0347
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0865
• Weighted residual factors for all reflections included in the refinement: 0.0874
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No