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Information card for entry 7150729
Preview
| Coordinates | 7150729.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | ChemSpider |
| Formula | C36 H50 N2 O13 S |
|---|---|
| Calculated formula | C36 H50 N2 O13 S |
| SMILES | c1cccc(CON[C@H](C(=O)N2[C@H]3[C@]4(CS2(=O)=O)CC[C@@H](C4(C)C)C3)[C@H](C)C[C@H]2[C@H]([C@H]([C@@H]([C@@H](COC(=O)C)O2)OC(=O)C)OC(=O)C)OC(=O)C)c1 |
| Title of publication | Diastereoselective addition of sugar radicals to camphorsultam glyoxilic oxime ether: a route toward C-glycosylthreonine and allothreonine |
| Authors of publication | Bragnier, Nicolas; Guillot, Regis; Scherrmann, Marie-Christine |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2009 |
| Journal volume | 7 |
| Journal issue | 19 |
| Pages of publication | 3918 - 3921 |
| a | 8.9756 ± 0.0005 Å |
| b | 17.3489 ± 0.001 Å |
| c | 12.2509 ± 0.0007 Å |
| α | 90° |
| β | 94.036 ± 0.002° |
| γ | 90° |
| Cell volume | 1902.94 ± 0.19 Å3 |
| Cell temperature | 100 ± 1 K |
| Ambient diffraction temperature | 100 ± 1 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0386 |
| Residual factor for significantly intense reflections | 0.0339 |
| Weighted residual factors for significantly intense reflections | 0.0857 |
| Weighted residual factors for all reflections included in the refinement | 0.0882 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 202017 (current) | 2017-10-14 | cif/ Marking COD entries in range 7 that are known to be related to ChemSpider entries using the _cod_related_entry data loop. |
7150729.cif |
| 180293 | 2016-03-26 | cif/7/15/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/15/07. |
7150729.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7150729.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7150729.cif |
| 1167 | 2010-05-13 | cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19. |
7150729.cif |
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