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Information card for entry 7150729
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
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 |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7150729.html
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.