The title compound, C(32)H(43)NO(4) x CH(4)O x H(2)O, has a nearly planar cyano-enone A ring in an otherwise normal oleanane triterpenoid. Rings A, B and C are non-chairs, but rings D and E adopt essentially cyclohexane chair conformations. The structure clearly establishes the C-D-E ring stereochemistry as trans-syn-cis, as predicted from a nuclear Overhauser effect (NOE) NMR measurement.

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http://dx.doi.org/10.1107/s010827010102176xDOI Listing

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