Information card for entry 4020698

Structure parameters

• Formula: C27 H29 N O5
• Calculated formula: C27 H29 N O5
• SMILES: O(C(=O)[C@H]1N(C[C@H](O)[C@@H]1CCO)C1(c2ccccc2c2ccccc12)c1ccccc1)C.O
• Title of publication: Stereocontrolled Synthesis of (-)-Kainic Acid from trans-4-Hydroxy-L-proline
• Authors of publication: Jean-François Poisson; Arturo Orellana; Andrew E. Greene
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 10860 - 10863
• a: 9.921 ± 0.005 Å
• b: 27.47 ± 0.01 Å
• c: 10.021 ± 0.005 Å
• α: 90°
• β: 118.67 ± 0.05°
• γ: 90°
• Cell volume: 2396 ± 2 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• 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