Information card for entry 4025943

Structure parameters

• Formula: C15 H20 Cl N O4
• Calculated formula: C15 H20 Cl N O4
• SMILES: ClCC[C@H]1C(=O)N[C@@]2([C@@]1(C)OC2=O)[C@@H]([C@H]1C=CCCC1)O
• Title of publication: Bioinspired Total Synthesis and Human Proteasome Inhibitory Activity of (-)-Salinosporamide A, (-)-Homosalinosporamide A, and Derivatives Obtained via Organonucleophile Promoted Bis-cyclizations
• Authors of publication: Henry Nguyen; Gil Ma; Tatiana Gladysheva; Trisha Fremgen; Daniel Romo
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2011
• Journal volume: 76
• Pages of publication: 2 - 12
• a: 10.6099 ± 0.0007 Å
• b: 10.7142 ± 0.0007 Å
• c: 13.7817 ± 0.0008 Å
• α: 90°
• β: 105.557 ± 0.004°
• γ: 90°
• Cell volume: 1509.26 ± 0.17 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 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: 0.0844
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.112
• Weighted residual factors for all reflections included in the refinement: 0.1229
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No