Information card for entry 1519613

Structure parameters

• Formula: C30 H48 O4
• Calculated formula: C30 H48 O4
• SMILES: O=C1CC[C@@]23[C@H](C1(C)C)CC[C@@H]1[C@]2(CC[C@]2([C@]1(CC[C@@H]2[C@@H]1CO[C@@H]([C@@H](O)C1)C(O)(C)C)C)C)C3
• Title of publication: Anti-inflammatory Terpenoids from the Leaves and Twigs of Dysoxylum gotadhora.
• Authors of publication: Jiang, Kan; Chen, Lu-Lin; Wang, Shu-Fang; Wang, Yi; Li, Ya; Gao, Kun
• Journal of publication: Journal of natural products
• Year of publication: 2015
• Journal volume: 78
• Journal issue: 5
• Pages of publication: 1037 - 1044
• a: 9.4572 ± 0.0003 Å
• b: 7.77569 ± 0.00019 Å
• c: 19.2277 ± 0.0005 Å
• α: 90°
• β: 103.188 ± 0.003°
• γ: 90°
• Cell volume: 1376.64 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0485
• Residual factor for significantly intense reflections: 0.0475
• Weighted residual factors for significantly intense reflections: 0.1284
• Weighted residual factors for all reflections included in the refinement: 0.131
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No