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Information card for entry 1512153
Preview
Coordinates | 1512153.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H36 O11 |
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Calculated formula | C19 H36 O11 |
SMILES | C1(C[C@@H]([C@H]([C@H]([C@@]1(/C=C/C(=O)C)O)C)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)O)(C)C.O.O |
Title of publication | Wilsonols A-L, Megastigmane Sesquiterpenoids from the Leaves of Cinnamomum wilsonii. |
Authors of publication | Shu, Penghua; Wei, Xialan; Xue, Yongbo; Li, Weijie; Zhang, Jinwen; Xiang, Ming; Zhang, Mengke; Luo, Zengwei; Li, Yan; Yao, Guangmin; Zhang, Yonghui |
Journal of publication | Journal of natural products |
Year of publication | 2013 |
Journal volume | 76 |
Journal issue | 7 |
Pages of publication | 1303 - 1312 |
a | 11.2174 ± 0.0002 Å |
b | 5.9846 ± 0.0001 Å |
c | 16.7692 ± 0.0004 Å |
α | 90° |
β | 98.354 ± 0.001° |
γ | 90° |
Cell volume | 1113.8 ± 0.04 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 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 | 0.0288 |
Residual factor for significantly intense reflections | 0.0286 |
Weighted residual factors for significantly intense reflections | 0.0741 |
Weighted residual factors for all reflections included in the refinement | 0.0743 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/1512153.html
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Users of the data should acknowledge the original authors of the
structural data.