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Information card for entry 4104257
Preview
Coordinates | 4104257.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | RAS-2-OCbz |
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Chemical name | Methyl 2-(1-(benzyloxycarbonyloxy)-2-methylpropyl)-4,4- dimethyl-3,5-dioxopyrrolidine-2-carboxylate |
Formula | C20 H25 N O7 |
Calculated formula | C20 H25 N O7 |
SMILES | N1[C@](C(=O)C(C1=O)(C)C)([C@H](OC(=O)OCc1ccccc1)C(C)C)C(=O)OC.N1[C@@](C(=O)C(C1=O)(C)C)([C@@H](OC(=O)OCc1ccccc1)C(C)C)C(=O)OC |
Title of publication | A Short and Efficient Synthesis of (-)-7-Methylomuralide, a Potent Proteasome Inhibitor |
Authors of publication | Ryan A. Shenvi; E. J. Corey |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2009 |
Journal volume | 131 |
Pages of publication | 5746 - 5747 |
a | 9.0015 ± 0.0001 Å |
b | 9.14 ± 0.0001 Å |
c | 12.5776 ± 0.0001 Å |
α | 88.129 ± 0.001° |
β | 78.693 ± 0.001° |
γ | 88.859 ± 0.001° |
Cell volume | 1014.08 ± 0.018 Å3 |
Cell temperature | 193 ± 2 K |
Ambient diffraction temperature | 193 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.044 |
Residual factor for significantly intense reflections | 0.0374 |
Weighted residual factors for significantly intense reflections | 0.0992 |
Weighted residual factors for all reflections included in the refinement | 0.1044 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
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/4104257.html
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Users of the data should acknowledge the original authors of the
structural data.