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Information card for entry 4107837
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Coordinates | 4107837.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | parc0107b |
---|---|
Formula | C30 H22 Cl N O9 |
Calculated formula | C30 H22 Cl N O9 |
SMILES | C1(=C2C(=O)c3c(c4c5cccc6C(=O)ON(c56)Cc4cc3O[C@@]2([C@H](CC1)O)C(=O)OC)O)OCc1ccc(cc1)Cl |
Title of publication | Isolation and Structure Elucidation of Parnafungins, Antifungal Natural Products that Inhibit mRNA Polyadenylation |
Authors of publication | Craig A. Parish; Scott K. Smith; Kathleen Calati; Deborah Zink; Kenneth Wilson; Terry Roemer; Bo Jiang; Deming Xu; Gerald Bills; Gonzalo Platas; Fernando Peláez; Maria Teresa Díez; Nancy Tsou; Arlene E. McKeown; Richard G. Ball; Mary Ann Powles; Lai Yeung; Paul Liberator; Guy Harris |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2008 |
Journal volume | 130 |
Pages of publication | 7060 - 7066 |
a | 7.6433 ± 0.0007 Å |
b | 11.0235 ± 0.001 Å |
c | 29.784 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2509.5 ± 0.4 Å3 |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 5 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for significantly intense reflections | 0.0424 |
Weighted residual factors for all reflections included in the refinement | 0.0942 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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