One-Shot Determination of Residual Dipolar Couplings: Application to the Structural Discrimination of Small Molecules Containing Multiple Stereocenters

2016 ◽  
Vol 81 (22) ◽  
pp. 11126-11131 ◽  
Author(s):  
Laura Castañar ◽  
Manuela Garcia ◽  
Erich Hellemann ◽  
Pau Nolis ◽  
Roberto R. Gil ◽  
...  
Keyword(s):  
Small Molecules ◽  
Residual Dipolar Couplings ◽  
Dipolar Couplings

A Novel Method for the Determination of Stereochemistry in Six-Membered Chairlike Rings Using Residual Dipolar Couplings

2003 ◽  
Vol 68 (5) ◽  
pp. 1786-1795 ◽  
Author(s):  
Jiangli Yan ◽  
Allen D. Kline ◽  
Huaping Mo ◽  
Michael J. Shapiro ◽  
Edward R. Zartler
Keyword(s):  
Residual Dipolar Couplings ◽  
Dipolar Couplings ◽  
Novel Method

Determination of the Relative Configuration of β-Amino Acid Esters Based on Residual Dipolar Couplings

2015 ◽  
Vol 2015 (31) ◽  
pp. 6801-6805 ◽  
Author(s):  
Thomas Niklas ◽  
Christian Steinmetzger ◽  
Weiping Liu ◽  
Daniel Zell ◽  
Dietmar Stalke ◽  
...  
Keyword(s):  
Amino Acid ◽  
Residual Dipolar Couplings ◽  
Dipolar Couplings ◽  
Amino Acid Esters ◽  
Relative Configuration ◽  
Acid Esters

scholarly journals Determination of the Structures of Symmetric Protein Oligomers from NMR Chemical Shifts and Residual Dipolar Couplings

2011 ◽  
Vol 133 (16) ◽  
pp. 6288-6298 ◽  
Author(s):  
Nikolaos G. Sgourakis ◽  
Oliver F. Lange ◽  
Frank DiMaio ◽  
Ingemar André ◽  
Nicholas C. Fitzkee ◽  
...  
Keyword(s):  
Residual Dipolar Couplings ◽  
Chemical Shifts ◽  
Dipolar Couplings ◽  
Nmr Chemical Shifts

scholarly journals Determination of the Absolute Configuration of 19-OH-(-)-Eburnamonine Using a Combination of Residual Dipolar Couplings, DFT Chemical Shift Predictions, and Chiroptics

2012 ◽  
Vol 7 (6) ◽  
pp. 1934578X1200700 ◽  
Author(s):  
Pablo Trigo-Mouriño ◽  
Roxana Sifuentes ◽  
Armando Navarro-Vázquez ◽  
Chakicherla Gayathri ◽  
Helena Maruenda ◽  
...  
Keyword(s):  
Chemical Shift ◽  
Absolute Configuration ◽  
Residual Dipolar Couplings ◽  
Indole Alkaloid ◽  
Dipolar Couplings ◽  
The Absolute ◽  
Natural Derivative ◽  
High Level ◽  
Configuration And Conformation

19-OH-(-)-eburnamonine 1 is a new indole alkaloid isolated from Bonafusia macrocalyx. A natural derivative from (-)-eburnamonine for which absolute configuration and conformation has been determined by making use of residual dipolar couplings enhanced NMR, circular dichroism spectra and high-level computations.

Residual Dipolar Couplings in Structure Determination of Biomolecules

ChemInform ◽  
2004 ◽  
Vol 35 (45) ◽  
Author(s):  
J. H. Prestegard ◽  
C. M. Bougault ◽  
A. I. Kishore
Keyword(s):  
Structure Determination ◽  
Residual Dipolar Couplings ◽  
Dipolar Couplings

Structural Discrimination in Small Molecules by Accurate Measurement of Long-Range Proton-Carbon NMR Residual Dipolar Couplings

2011 ◽  
Vol 123 (33) ◽  
pp. 7718-7722 ◽  
Author(s):  
Pablo Trigo-Mouriño ◽  
Armando Navarro-Vázquez ◽  
Jinfa Ying ◽  
Roberto R. Gil ◽  
Ad Bax
Keyword(s):  
Small Molecules ◽  
Long Range ◽  
Residual Dipolar Couplings ◽  
Dipolar Couplings ◽  
Nmr Residual Dipolar Couplings

scholarly journals NMR Spectroscopic Determination of the Solution Structure of a Branched Nucleic Acid from Residual Dipolar Couplings by Using Isotopically Labeled Nucleotides

2004 ◽  
Vol 43 (2) ◽  
pp. 187-192 ◽  
Author(s):  
Bernd N. M. van Buuren ◽  
Jürgen Schleucher ◽  
Valentin Wittmann ◽  
Christian Griesinger ◽  
Harald Schwalbe ◽  
...  
Keyword(s):  
Nucleic Acid ◽  
Solution Structure ◽  
Residual Dipolar Couplings ◽  
Dipolar Couplings ◽  
Spectroscopic Determination

scholarly journals Determination of Conformational Equilibria in Proteins Using Residual Dipolar Couplings

2011 ◽  
Vol 7 (12) ◽  
pp. 4189-4195 ◽  
Author(s):  
Alfonso De Simone ◽  
Rinaldo W. Montalvao ◽  
Michele Vendruscolo
Keyword(s):  
Residual Dipolar Couplings ◽  
Dipolar Couplings ◽  
Conformational Equilibria
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