Information card for entry 4516798

Structure parameters

• Formula: C22 H35 N O6 Si
• Calculated formula: C22 H35 N O6 Si
• Title of publication: Total Syntheses of Bulgecins A, B, and C and Their Bactericidal Potentiation of the β-Lactam Antibiotics.
• Authors of publication: Tomoshige, Shusuke; Dik, David A.; Akabane-Nakata, Masaaki; Madukoma, Chinedu S.; Fisher, Jed F.; Shrout, Joshua D.; Mobashery, Shahriar
• Journal of publication: ACS infectious diseases
• Year of publication: 2018
• Journal volume: 4
• Journal issue: 6
• Pages of publication: 860 - 867
• a: 23.6556 ± 0.001 Å
• b: 6.5523 ± 0.0002 Å
• c: 18.1925 ± 0.0007 Å
• α: 90°
• β: 123.699 ± 0.003°
• γ: 90°
• Cell volume: 2345.98 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.1311
• Weighted residual factors for all reflections included in the refinement: 0.1319
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No