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  • 1
    Electronic Resource
    Electronic Resource
    Springer
    Journal of chemical crystallography 23 (1993), S. 195-201 
    ISSN: 1572-8854
    Source: Springer Online Journal Archives 1860-2000
    Topics: Geosciences , Physics
    Notes: Abstract (3αβ(Z),4β,6aα,9aβ,9bβ)-(±)-3a,4,6a,7,8,9,9a,9b-octahydro-4,7,7, 9b-tetramethyl-3a-[3-(methoxymethyloxy)-3-methyl-1-butenyl]-5H-naphto[1,8-de]-1,3-dioxin-6-one (I), C22H36O5,M r=378.51, monoclinic,P21/n,a=6.330(1),b=14.576(2),c=22.837(2)Å,β=93.04(1)°,V=2104.1(2)Å3,Z=4,D c=1.19 Mg/m3, λ(MoKα)=0.71069Å,β=0.8 cm−1,F(000)=832,T=298 K,R=0.054 for 1971 observed reflections; (7aβ,10aα,10bβ,12α)-(±)-7a,9, 10,10a,10b,11,12,12a-octahydro-2,2,10,10,10b,12a-hexamethyl-2H,8H-1-benzopyrano[4a,5,6,-de][1,3,2]-benzodioxin-11-one (II), C20H29O4,M r=334.5, triclinic,P-1,a=10.595(2),b=12.152(1),c=8.073(1)Å,α=106.53(1),β=105.65(1), γ=66.29(1)°,V=897.9(2)Å3,Z=2,D c=1.24 Mg/m3, λ(MoKα)=0.71069Å,β=0.8 cm−1,F(000)=362,T=298 K,R=0.046 for 2848 observed reflections; (7aβ,10aα,10bβ,12α, 12aα)-(±)-7a,9,10,10a,10b,11,12,12a-octahydro-2,2,10,10,10b,12a-hexamethyl-2H,8H-1-benzopyrano[4a,5,6-de][1,3,2]-benzodioxin-11, 12-diol (III), C20H32O5 (two molecules in the asymmetric unit),M r=352.2, triclinic,P-1,a=12.948(3),b=13.615(3),c=12.197(4)Å,α=101.16(2),β=111.88(2), γ=69.48(2)°,V=1863.8(9)Å3,Z=2,D C=1.26 Mg/m3,λ(MoKα)=0.71069 Å,β=0.8 cm−1,F(000)=768,T=298 K,R=0.060 for 4570 observed reflections; 4-acetoxy-4-[[(4aβ,5α,8aβ)-(±)-hexahydro-4a,6,6-trimethyl-4H-1,3-benzodioxin-4-one]-5-yl]butan-2-one (IV), C17H26O6,M r=326.4, monoclinic,P21/c,a=10.495(2),b=12.050(2),c=14.216(2)Å,β=108.51(1)°,V=1704.8(5)Å3,Z=4,D c=1.27 Mg/m3,λ(MoKα)=0.71069 Å,β=0.9 cm−1,F(000)=704,T=298 K,R=0.049 for2455 observed reflections; (3aα,4β,5β,6β,6aα,9aβ,9bβ)-(±)-4,5-epoxy-decahydro-3, 3a-dihydroxy-2-ethoxy-4,7,7,9b-tetramethyl-naphto-[1,8-bc]-pyran-6-ol-acetate (V), C20H32O7,M r=383.5, monoclinic,C2/c,a=10.353(2),b=17.975(3),c=21.188(3)Å,β=91.29(1)°,V=3942(1)Å3,Z=8,D c=1.29 Mg/m3,λ(MoKα)=0.71069 Å,β=0.8 cm−1,F(000)=1664,T=298 K,R=0.051 for 2120 observed reflections. We report here the complete structures of four decalin derivatives (compoundsI, II, III, V) and one related compound (compoundIV) synthetized in order to find an efficient synthetic approach for the natural productforskolin.
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