Pj. Cox et al., MOLECULAR-STRUCTURES OF 4 TRITERPENOIDS - X-RAY CRYSTALLOGRAPHIC ANALYSIS OF METHYL -TRIACETOXY-19-ALPHA-HYDROXYURS-12-EN-28-BETA-OATE, Journal of crystallographic and spectroscopic research, 23(10), 1993, pp. 779-783
A triterpenoid glycoside has been isolated from the roots of a herb us
ed in traditional Chinese medicine. The molecular structure of this co
mpound and its derivatives have been determined by spectroscopic studi
es and an X-ray analysis of the 2alpha,3beta,23alpha-triacetoxy-28beta
-methyl ester of the aglycone. This aglycone belongs to the ursene str
ucture series. The hydroxy group on ring E of these triterpenoids is a
lpha orientated and the side chains at C(2), C(3), C(4) and C(17) are
alpha, beta, alpha and beta orientated, respectively. The C ring, whic
h has a double bond at C(12)=C(13), adopts a sofa conformation.