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Information card for entry 1561440
Preview
| Coordinates | 1561440.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H48 O4 |
|---|---|
| Calculated formula | C38 H48 O4 |
| Title of publication | Diverse Polycyclic Polyprenylated Acylphloroglucinol Congeners with Anti-Nonalcoholic Steatohepatitis Activity from <i>Hypericum forrestii</i>. |
| Authors of publication | Lu, Wei-Jia; Xu, Wen-Jun; Zhang, Mei-Hui; Zhang, Yan-Qiu; Li, Yi-Ran; Zhang, Hao; Luo, Jun; Kong, Ling-Yi |
| Journal of publication | Journal of natural products |
| Year of publication | 2021 |
| a | 12.3525 ± 0.0002 Å |
| b | 12.3525 ± 0.0002 Å |
| c | 79.6448 ± 0.0018 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 10524.4 ± 0.3 Å3 |
| Cell temperature | 143 K |
| Ambient diffraction temperature | 143.15 K |
| Number of distinct elements | 3 |
| Space group number | 179 |
| Hermann-Mauguin space group symbol | P 65 2 2 |
| Hall space group symbol | P 65 2 (0 0 1) |
| Residual factor for all reflections | 0.0799 |
| Residual factor for significantly intense reflections | 0.0796 |
| Weighted residual factors for significantly intense reflections | 0.181 |
| Weighted residual factors for all reflections included in the refinement | 0.1812 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.236 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 263535 (current) | 2021-04-02 | cif/ Adding structures of 1561440 via cif-deposit CGI script. |
1561440.cif |
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Users of the data should acknowledge the original authors of the
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