Information card for entry 7161041

Structure parameters

• Formula: C20 H33 N O5
• Calculated formula: C20 H33 N O5
• Title of publication: Synthesis-enabled conformational assignment of natural <i>N</i>-acyl L-phenylalanine derivatives from freshwater sponge-associated <i>Micromonospora</i> sp. MS-62.
• Authors of publication: Kim, Jiyool; Kang, Jueun; Han, Yongseong; Sim, Jinchan; Park, Young-Tae; Kim, Young-Joo; Kwon, Jaeyoung; Cho, Ja Young; Kim, Taejung
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2026
• Journal volume: 24
• Journal issue: 3
• Pages of publication: 597 - 600
• a: 16.744 ± 0.002 Å
• b: 5.1551 ± 0.0007 Å
• c: 25.863 ± 0.004 Å
• α: 90°
• β: 95.926 ± 0.004°
• γ: 90°
• Cell volume: 2220.5 ± 0.5 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 4
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.1796
• Residual factor for significantly intense reflections: 0.086
• Weighted residual factors for significantly intense reflections: 0.234
• Weighted residual factors for all reflections included in the refinement: 0.3008
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No