Two metabolites, the known antitumor macrolide hypothemycin 1 and its new 5'-O-methyl ether, 5'-O-methylhypothemycin 2, and the known steroid ergosterol 3, were isolated from a Phoma sp. The structures were elucidated by means of spectroscopic data analysis, and the absolute configuration of hypothemycin 1 was confirmed by single crystal X-ray analysis in combination with the new solid-state CD/TDDFT methodology. Since the solid-state CD spectrum shows contributions from intermolecular interactions in the crystal, 1 represents a critical test case for our solid-state CD/TDDFT approach.
Absolute configuration of hypothemycin and 5'-O-methylhypothemycin from Phoma sp.—a test case for solid state CD/TDDFT approach
PESCITELLI, GENNARO;SALVADORI, PIERO;
2007-01-01
Abstract
Two metabolites, the known antitumor macrolide hypothemycin 1 and its new 5'-O-methyl ether, 5'-O-methylhypothemycin 2, and the known steroid ergosterol 3, were isolated from a Phoma sp. The structures were elucidated by means of spectroscopic data analysis, and the absolute configuration of hypothemycin 1 was confirmed by single crystal X-ray analysis in combination with the new solid-state CD/TDDFT methodology. Since the solid-state CD spectrum shows contributions from intermolecular interactions in the crystal, 1 represents a critical test case for our solid-state CD/TDDFT approach.File in questo prodotto:
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