Capsidiol and 1-epicapsidiol: absolute configuration, nmr, and optical spectra of the dibenzoates

1981 ◽  
Vol 59 (15) ◽  
pp. 2303-2305 ◽  
Author(s):  
M. J. Stillman ◽  
J. B. Stothers ◽  
A. Stoess

Application of the exciton chirality method has confirmed that capsidiol, a unique eremophilane, has the absolute stereochemistry depicted in 1. The 1H and 13Cmr, circular dichroism, and magnetic circular dichroism spectra of capsidiol and 1-epicapsidiol dibenzoates are discussed.

RSC Advances ◽  
2021 ◽  
Vol 11 (14) ◽  
pp. 8411-8419
Author(s):  
Jakub Kaminský ◽  
Valery Andrushchenko ◽  
Petr Bouř

Electronic absorption, natural and magnetic circular dichroism spectra of several nucleosides are simulated to understand their dependence on molecular dynamics and environment, their sensitivity to nucleoside pairing and stacking in nucleic acids.


1981 ◽  
Vol 103 (11) ◽  
pp. 3201-3203 ◽  
Author(s):  
Joseph D. Keegan ◽  
Alan M. Stolzenberg ◽  
Yu-Cheng Lu ◽  
Robert E. Linder ◽  
Guenter Barth ◽  
...  

2013 ◽  
Vol 69 (11) ◽  
pp. 1411-1413 ◽  
Author(s):  
Yuko Kawanami ◽  
Hidekazu Tanaka ◽  
Jun-ichi Mizoguchi ◽  
Nobuko Kanehisa ◽  
Gaku Fukuhara ◽  
...  

The absolute configuration has been established of the enantiopureanti-head-to-head cyclodimer of anthracene-2-carboxylic acid (AC) cocrystallized with L-propinol and dichloromethane [systematic name: (S)-2-(hydroxymethyl)pyrrolidin-1-ium (5R,6S,11R,12S)-8-carboxy-5,6,11,12-tetrahydro-5,12:6,11-bis([1,2]benzeno)dibenzo[a,e][8]annulene-2-carboxylate dichloromethane monosolvate], C5H12NO+·C30H19O4−·CH2Cl2. In the crystal structure, the AC dimer interacts with L-prolinol through a nine-membered hydrogen-bonded ring [R22(9)], while the dichloromethane molecule is incorporated to fill the void space. The absolute configuration determined in this study verifies a recent assignment made by comparing theoreticalversusexperimental circular dichroism spectra.


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