Information card for entry 4020801

Structure parameters

• Formula: C20 H20 O6
• Calculated formula: C20 H20 O6
• SMILES: [C@H]1([C@H]2CO[C@H]([C@H]2CO1)c1cc2c(cc1)OCO2)c1cc(c(cc1)O)OC
• Title of publication: A Versatile Stereoselective Synthesis of endo,exo-Furofuranones: Application to the Enantioselective Synthesis of Furofuran Lignans
• Authors of publication: Nigel A. Swain; Richard C. D. Brown; Gordon Bruton
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 122 - 129
• a: 5.7909 ± 0.0003 Å
• b: 9.3699 ± 0.0004 Å
• c: 15.5907 ± 0.0008 Å
• α: 90°
• β: 95.641 ± 0.002°
• γ: 90°
• Cell volume: 841.86 ± 0.07 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No