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Information card for entry 7157793
Preview
| Coordinates | 7157793.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C70 H92 O26 |
|---|---|
| Calculated formula | C70 H92 O26 |
| Title of publication | Carapanins A‒C: new limonoids from andiroba (Carapa guianensis) fruit oil |
| Authors of publication | Kikuchi, Takashi; Akita, Keiko; Koike, Hiroki; In, Yasuko; Yamada, Takeshi; Tanaka, Reiko |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2020 |
| Journal volume | 18 |
| Journal issue | 45 |
| Pages of publication | 9268 - 9274 |
| a | 11.0913 ± 0.0001 Å |
| b | 11.0913 ± 0.0001 Å |
| c | 92.9928 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 9907.06 ± 0.14 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 170 |
| Hermann-Mauguin space group symbol | P 65 |
| Hall space group symbol | P 65 |
| Residual factor for all reflections | 0.0952 |
| Residual factor for significantly intense reflections | 0.0948 |
| Weighted residual factors for significantly intense reflections | 0.2282 |
| Weighted residual factors for all reflections included in the refinement | 0.2284 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.163 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 259462 (current) | 2020-12-02 | cif/ Adding structures of 7157793, 7157794 via cif-deposit CGI script. |
7157793.cif |
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Users of the data should acknowledge the original authors of the
structural data.