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Information card for entry 1543450
Preview
| Coordinates | 1543450.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | Conoduzidine A |
|---|---|
| Formula | C19 H20 N2 O2 |
| Calculated formula | C19 H20 N2 O2 |
| SMILES | c12c3CCN4CC[C@H]5[C@](CC(=O)n2c2c3cccc2)(CCO5)[C@@H]14 |
| Title of publication | Ibogan, Aspidosperman, Vincamine, and Bisindole Alkaloids from a Malayan Tabernaemontana corymbosa: Iboga Alkaloids with C-20α Substitution. |
| Authors of publication | Nge, Choy-Eng; Chong, Kam-Weng; Thomas, Noel F.; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok |
| Journal of publication | Journal of natural products |
| Year of publication | 2016 |
| Journal volume | 79 |
| Journal issue | 5 |
| Pages of publication | 1388 - 1399 |
| a | 11.7328 ± 0.0001 Å |
| b | 13.0767 ± 0.0001 Å |
| c | 19.2454 ± 0.0002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2952.75 ± 0.05 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0358 |
| Residual factor for significantly intense reflections | 0.0354 |
| Weighted residual factors for significantly intense reflections | 0.0898 |
| Weighted residual factors for all reflections included in the refinement | 0.0901 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.072 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301779 (current) | 2025-08-18 | Add cross-references to PubChem compounds in COD range 1/54 Each referenced PubChem compound corresponds to the full crystal structure. |
1543450.cif |
| 183541 | 2016-06-16 | cif/ Adding structures of 1543450 via cif-deposit CGI script. |
1543450.cif |
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Users of the data should acknowledge the original authors of the
structural data.