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Information card for entry 7160632
Preview
| Coordinates | 7160632.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H52 O10 |
|---|---|
| Calculated formula | C38 H52 O10 |
| Title of publication | DMSO enhances the biosynthesis of epoxyquinols in <i>Pestalotiopsis</i> sp. (strain IQ-011) and yields new [4 + 2] cycloaddition dimers. |
| Authors of publication | Aguilar-Ramírez, Enrique; Rivera-Chávez, José; Miranda-Rosas, Mario Yair; Martínez-Otero, Diego |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2025 |
| Journal volume | 23 |
| Journal issue | 18 |
| Pages of publication | 4525 - 4536 |
| a | 10.9462 ± 0.0006 Å |
| b | 10.9462 ± 0.0006 Å |
| c | 50.685 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 5259.4 ± 0.6 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 154 |
| Hermann-Mauguin space group symbol | P 32 2 1 |
| Hall space group symbol | P 32 2" |
| Residual factor for all reflections | 0.1353 |
| Residual factor for significantly intense reflections | 0.1256 |
| Weighted residual factors for significantly intense reflections | 0.2737 |
| Weighted residual factors for all reflections included in the refinement | 0.2785 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300381 (current) | 2025-07-06 | cif/ Adding structures of 7160632 via cif-deposit CGI script. |
7160632.cif |
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Users of the data should acknowledge the original authors of the
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