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Crystal Structure of Macrocalyxin J

Crystal Structure of Macrocalyxin J
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摘要 The title compound, (1α,6β, 11β,14α)-1,7:6,20-diepoxy-6,1 1-dihydroxy- 6,7-secoent- kaur- 16-ene-7,15-dione- 14-acetate (macrocalyxin J), is a diterpenoid which was isolated from the leaves of Rabdosia macrocalyx and characterized by single-crystal X-ray diffraction. It crystallizes in orthorhombic, space group P212121 with α= 9.3608(8), b = 14.9787(12), c = 15.5750(13) A, Z = 4, V = 2183.8(3) A^3, C22H30O9, Mr= 438.46, Dc= 1.334 g/m^3,μ(MoKα) = 0.103 mm^-1, F(000) = 936, the final R = 0.0532 and wR = 0.1262 for 2252 observed reflections (I 〉 2σ(I)). In the molecule, three six-membered rings adopt chair, boat and slightly distorted boat conformations, respectively, while both five-membered rings have approximate envelope conformations. The title compound, (1α,6β, 11β,14α)-1,7:6,20-diepoxy-6,1 1-dihydroxy- 6,7-secoent- kaur- 16-ene-7,15-dione- 14-acetate (macrocalyxin J), is a diterpenoid which was isolated from the leaves of Rabdosia macrocalyx and characterized by single-crystal X-ray diffraction. It crystallizes in orthorhombic, space group P212121 with α= 9.3608(8), b = 14.9787(12), c = 15.5750(13) A, Z = 4, V = 2183.8(3) A^3, C22H30O9, Mr= 438.46, Dc= 1.334 g/m^3,μ(MoKα) = 0.103 mm^-1, F(000) = 936, the final R = 0.0532 and wR = 0.1262 for 2252 observed reflections (I 〉 2σ(I)). In the molecule, three six-membered rings adopt chair, boat and slightly distorted boat conformations, respectively, while both five-membered rings have approximate envelope conformations.
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 北大核心 2007年第3期299-302,共4页 结构化学(英文)
基金 the National Natural Science Foundation of China (No. 20472073) the Natural Science Foundation of Zhejiang Province (No. Y404357)
关键词 crystal structure macrocalyxin J Rabdosia macrocalyx crystal structure, macrocalyxin J, Rabdosia macrocalyx
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  • 1Chen,S.H.; Wang,J.; Ni,G.Y.Chin.Trad.Herb.Drugs 1984,19,547-548.
  • 2Zhao,A.H.; Zhang,Y.; Xu,Z.H.; Liu,J.W.; Jia,W.Helv.Chim.Acta 2004,87,3160-3166.
  • 3Xiang,W.;Li,R.T.;Wang,Z.Y.;Li,S.H.;Zhao,Q.S.;Zhang,H.J.;Sun,H.D.Phytochemistry 2004,65,1173-1177.
  • 4Hou,A.J.;Zhao,Q.S.;Li,M.L.;Jiang,B.;Lin,Z.W.;Sun,H.D.;Zhou,Y.P.;Lu,Y.;Zheng,Q.T.Phytochemistry 2001,58,179-183.
  • 5Shi,H.; He,S.; He,L.; Pan,Y.J.Chem.J.Chinese Universities.Accepted.
  • 6Xue,S.J.;Duan,L.P.;Ke,S.Y.;Li,J.Z.;Guo,Y.L.Chinese J.Struct.Chem.2005,24,730-734.
  • 7Bruker.SADABS (Version 2.03),SAINT(Version 6.02),SMART(Version 5.62) and SHELXTL.Bruker AXS Inc.,Madison,Wisconsin,USA 2002.
  • 8Sheldrick,G.M.SHELXS97 and SHELXL97.University of Gottingcn,Germany 1997.

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