8β-Eth-oxy-eremophil-3,7(11)-diene-8α,12;6α,15-diolide.

Acta Crystallogr Sect E Struct Rep Online

School of Pharmacy, Lanzhou University, Lanzhou 730000, People's Republic of China.

Published: September 2013

The title compound, C17H20O5, an eremophilane sesquiternoid, was isolated from the roots of Ligularia lapathifolia. The mol-ecule contains four fused rings of which the six-membered ring A adopts a half-chair conformation, the six-membered ring B adopts a chair conformation, the five-membered ring C is almost planar (r.m.s. deviation = 0.015 Å) and the five-membered ring D adopts an envelope conformation with the quaternary C atom as the flap. The methyl and the eth-oxy groups adopt a syn conformation and the A/B ring junction is cis-fused. No directional inter-molecular inter-actions could be identified in the crystal.

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Source
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC3770365PMC
http://dx.doi.org/10.1107/S1600536813015729DOI Listing

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