Information card for entry 4020683

Structure parameters

• Formula: C15 H24 O5
• Calculated formula: C15 H24 O5
• SMILES: O1[C@H]2[C@@H](OC1(C)C)C=CCC[C@H](O)C(=O)O[C@@H]2CCC
• Title of publication: Stereoselective Total Synthesis and Absolute Configuration of the Natural Decanolides (-)-Microcarpalide and (+)-Lethaloxin. Identity of (+)-Lethaloxin and (+)-Pinolidoxin
• Authors of publication: Jorge García-Fortanet; Juan Murga; Eva Falomir; Miguel Carda; J. Alberto Marco
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 9822 - 9827
• a: 12.43 ± 0.002 Å
• b: 5.3168 ± 0.001 Å
• c: 12.926 ± 0.002 Å
• α: 90°
• β: 106.652 ± 0.004°
• γ: 90°
• Cell volume: 818.4 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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