(1R,2S,4S,4aS,8S,8aS)-4-羟基-8,8a-二甲基-10-氧代-2,3,4,7,8,8a-六氢-1H-4a,1-(环氧亚甲基)-萘-2-基乙酸酯
(1R,2S,4S,4aS,8S,8aS)-4-Hy-droxy-8,8a-dimethyl-10-oxo-2,3,4,7,8,8a-hexa-hydro-1H-4a,1-(ep-oxy-methano)-naphthalen-2-yl acetate.
作者信息
Selaïmia-Ferdjani Ouassila, Bidjou-Haiour Chahra, Planchat Aurelien, Pipelier Muriel
机构信息
Laboratoire de Synthèse Organique Modélisation et Optimisation des Procédés Chimiques, Université Badji-Mokhtar Annaba, BP12, 23000 Annaba, Algeria ; Université de Nantes, CNRS, Laboratoire CEISAM-UMR 6230, Faculté des Sciences et des Techniques, 2 rue de la Houssinière, BP 92208, 44322 Nantes Cedex 3, France.
出版信息
Acta Crystallogr Sect E Struct Rep Online. 2013 May 22;69(Pt 6):o938-9. doi: 10.1107/S1600536813013524. Print 2013 Jun 1.
The title compound, C15H20O5, presents a bis-norsesquiterpene skeleton, with a trans-deca-line backbone constrained by the lactone bridge. The α-hy-droxy substituent and the methyl group belonging to the two deca-line rings are in axial positions, whereas the other methyl group and the acyl group occupy the sterically preferred equatorial positions. The mol-ecular structure is stabilized by an intra-molecular C-H⋯O hydrogen bond. In the crystal, mol-ecules are linked into chains along [010] by O-H⋯O hydrogen bonds.
标题化合物C₁₅H₂₀O₅呈现出一种双降倍半萜骨架，其反式十氢化萘主链由内酯桥限制。属于两个十氢化萘环的α-羟基取代基和甲基处于轴向位置，而另一个甲基和酰基占据空间上更有利的赤道位置。分子结构通过分子内C-H⋯O氢键得以稳定。在晶体中，分子通过O-H⋯O氢键沿[010]方向连接成链。
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