Information card for entry 7159071

Structure parameters

• Formula: C32 H38 O10
• Calculated formula: C32 H38 O10
• SMILES: O(C(=O)C)[C@@H]1[C@@H]2[C@H](OC(=O)[C@H]2C)[C@]23[C@@H]4C(=O)C(=C([C@@H]4[C@H](C=C2[C@@](O)(C)C1)[C@]3(O)C)C)[C@H]1OC(=O)[C@H]([C@@H]1/C=C/C(=O)C)C
• Title of publication: Artemongolides A-F, undescribed sesquiterpenoid dimers from <i>Artemisia mongolica</i> and their antihepatic fibrosis activities.
• Authors of publication: Shang, Chong; Huang, Xiao-Yan; Wang, Yuan; Dong, Wei; He, Xiao-Feng; Li, Tian-Ze; Chen, Ji-Jun
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2023
• Journal volume: 21
• Journal issue: 4
• Pages of publication: 823 - 831
• a: 23.9849 ± 0.0014 Å
• b: 14.481 ± 0.0008 Å
• c: 12.3512 ± 0.0006 Å
• α: 90°
• β: 117.884 ± 0.003°
• γ: 90°
• Cell volume: 3791.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0898
• Residual factor for significantly intense reflections: 0.0728
• Weighted residual factors for significantly intense reflections: 0.2117
• Weighted residual factors for all reflections included in the refinement: 0.2296
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No