title: Circular dichroism calculation for natural products.
abstract: Determination of the absolute configuration (AC) is often a challenging aspect in the structure elucidation of natural products. When chiral compounds possess appropriate chromophore(s), electronic circular dichroism (ECD) may provide a powerful approach to the determination of their absolute configuration. Recently, ECD calculations by time-dependent density functional theory (TDDFT) have come to be used more commonly. In the present review, we give several examples of recent studies using TDDFT-calculated ECD spectra for the AC determination of natural products.
authors.affiliation: Faculty of Pharmaceutical Sciences, Hoshi University, Ebara 2-4-41 Shinagawa-ku, Tokyo, 142-8501, Japan.
authors.forename: Alfarius Eko
authors.initials: AE
authors.lastname: Nugroho
authors.forename: Hiroshi
authors.initials: H
authors.lastname: Morita
mesh_terms: D001688:Biological Products / Q000737:chemistry*; D002942:Circular Dichroism; D003198:Computer Simulation; D008958:Models, Molecular; D008968:Molecular Conformation
chemical_list: D001688:Biological Products
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