H. Huang et al., Crystal structure of spiro[5-1-menthyloxy-3-bromo-butyrolacto cyclopropane-3 '',3 '-(4 '-menthoxy-5 ' menthyloxy-butyrolactone)], CHIN J ST C, 19(3), 2000, pp. 207-211
The crystal structure of the title compound C29H45BrO7(M-r = 585.56) is rep
orted herein. The crystal is attributed to orthorhombic system and P2(1)2(1
)2(1) space group. The crystal lattice parameters are a = 9.748(4), b = 12.
537(5), c = 25.851 (9) Angstrom,V = 3159 (2) Angstrom(3), Z = 4, D-x = 1.23
1g/cm(3), mu = 1.341mm(-1), F (000) = 1240. The reflection factor [F-2 > 2
sigma (F-2)], R = 0.0415, R-w = 0.0609. The title compound contains 5 rings
and 12 chiral centers. The two six-rings of menthyloxy are shown as chair
conformation and the pentacyclic lactones are also shown as envelope form.
They are fused with cyclopropane ring to form a spiro[2.4] ring and a fused
[3. 1. 0] ring, respectively. The absolute configuration of this compound
at the new stereogenic centers was established as C(13)(S), C(14)(S), C(15)
(R), C(16)(R). There is no symmetric factor in the crystal structure.