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Information card for entry 4131675
Preview
| Coordinates | 4131675.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H29 N O5 |
|---|---|
| Calculated formula | C25 H29 N O5 |
| SMILES | N1(C(=O)OC[C@@H]1Cc1ccccc1)C(=O)[C@H](C)[C@H](OC(=O)CC)CCc1ccccc1 |
| Title of publication | Biomimetic Synthesis of Lankacidin Antibiotics. |
| Authors of publication | Zheng, Kuan; Shen, Defeng; Hong, Ran |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2017 |
| Journal volume | 139 |
| Journal issue | 37 |
| Pages of publication | 12939 - 12942 |
| a | 13.443 ± 0.0014 Å |
| b | 5.8222 ± 0.0006 Å |
| c | 15.2575 ± 0.0016 Å |
| α | 90° |
| β | 101.159 ± 0.002° |
| γ | 90° |
| Cell volume | 1171.6 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0723 |
| Residual factor for significantly intense reflections | 0.0527 |
| Weighted residual factors for significantly intense reflections | 0.1481 |
| Weighted residual factors for all reflections included in the refinement | 0.1674 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.981 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 241848 (current) | 2019-11-25 | cif/ Adding structures of 4131675 via cif-deposit CGI script. |
4131675.cif |
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