Information card for entry 1552585

Structure parameters

• Common name: euphoscopin L
• Chemical name: euphoscopin L
• Formula: C29.75 H38.75 O7.75
• Calculated formula: C29.75 H38.75 O7.75
• SMILES: C1[C@H]([C@@H]([C@@H]2/C=C(C)/[C@H](O)CC(=O)C(C)(C)C/C=C(/C(=O)[C@@]12OC(=O)C)C)OC(=O)c1ccccc1)C.CO
• Title of publication: Macrocyclic Diterpenoids from <i>Euphorbia helioscopia</i> and Their Potential Anti-inflammatory Activity.
• Authors of publication: Su, Jun-Cheng; Cheng, Wen; Song, Jian-Guo; Zhong, Yuan-Lin; Huang, Xiao-Jun; Jiang, Ren-Wang; Li, Yao-Lan; Li, Man-Mei; Ye, Wen-Cai; Wang, Ying
• Journal of publication: Journal of natural products
• Year of publication: 2019
• Journal volume: 82
• Journal issue: 10
• Pages of publication: 2818 - 2827
• a: 9.3591 ± 0.0004 Å
• b: 12.5274 ± 0.0005 Å
• c: 12.547 ± 0.0005 Å
• α: 74.614 ± 0.004°
• β: 88.037 ± 0.003°
• γ: 88.948 ± 0.003°
• Cell volume: 1417.45 ± 0.1 ų
• Cell temperature: 173 ± 0.1 K
• Ambient diffraction temperature: 173 ± 0.1 K
• Number of distinct elements: 3
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.037
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.1046
• Weighted residual factors for all reflections included in the refinement: 0.1053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No