Academic Journal
Crystal structure and Hirshfeld surface analysis of the naturally occurring cassane-type diterpenoid, 6β-cinnamoyl-7β-hydroxyvouacapen-5α-ol
| العنوان: | Crystal structure and Hirshfeld surface analysis of the naturally occurring cassane-type diterpenoid, 6β-cinnamoyl-7β-hydroxyvouacapen-5α-ol |
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| المؤلفون: | K. Osahon Ogbeide, Rajesh Kumar, Mujeeb-Ur-Rehman, Bodunde Owolabi, Abiodun Falodun, M. Iqbal Choudhary, Sammer Yousuf |
| المصدر: | Acta Crystallographica Section E: Crystallographic Communications, Vol 74, Iss 3, Pp 385-389 (2018) |
| بيانات النشر: | International Union of Crystallography, 2018. |
| سنة النشر: | 2018 |
| المجموعة: | LCC:Crystallography |
| مصطلحات موضوعية: | crystal structure, Caesalpinia pulcherrima, cassane-type diterpenoids, Hirshfeld surface analysis, electrostatic potential, Crystallography, QD901-999 |
| الوصف: | The title compound, C29H36O5, a cassane-type diterpenoid {systematic name: (4aR,5R,6R,6aS,7R,11aS,11bR)-4a,6-dihydroxy-4,4,7,11b-tetramethyl-1,2,3,4,4a,5,6,6a,7,11,11a,11b-dodecahydrophenanthro[3,2-b]furan-5-yl 3-phenylprop-2-enoate}, was isolated from a medicinally important plant, Caesalpinia pulcherrima (Fabaceae). In the molecule, three cyclohexane rings are trans-fused and adopt chair, chair and half-chair conformations. In the crystal, molecules are linked via O—H...O hydrogen bonds, forming a tape structure along the b-axis direction. The tapes are further linked into a double-tape structure through C—H...π interactions. The Hirshfeld surface analysis indicates that the contributions to the crystal packing are H...H (65.5%), C...H (18.7%), O...H (14.5%) and C...O (0.3%). |
| نوع الوثيقة: | article |
| وصف الملف: | electronic resource |
| اللغة: | English |
| تدمد: | 2056-9890 20569890 |
| Relation: | http://scripts.iucr.org/cgi-bin/paper?S2056989018002499; https://doaj.org/toc/2056-9890 |
| DOI: | 10.1107/S2056989018002499 |
| URL الوصول: | https://doaj.org/article/98fd6dac3249435c8c4c8b1c87f3dff7 |
| رقم الانضمام: | edsdoj.98fd6dac3249435c8c4c8b1c87f3dff7 |
| قاعدة البيانات: | Directory of Open Access Journals |
Full Text Finder | تدمد: | 20569890 |
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| DOI: | 10.1107/S2056989018002499 |