1889-67-4, Name is (2,3-Dimethylbutane-2,3-diyl)dibenzene, molecular formula is C18H22, belongs to quinuclidines compound, is a common compound. In a patnet, author is Primozic, Ines, once mentioned the new application about 1889-67-4, Application In Synthesis of (2,3-Dimethylbutane-2,3-diyl)dibenzene.
Binding Modes of Quinuclidinium Esters to Butyrylcholinesterase
The orientations of chiral quinuclidin-3-ol esters and benzoylcholine in the active site of horse butyrylcholinesterase have been investigated by flexible ligand docking. Change of the esters’ acyl moiety as well as the substituent at the quinuclidinium nitrogen atom affected the activity and stereoselectivity of the biotransformations. Analysis of interactions in the active site revealed the most important binding patterns for enantiomers, which define their reactivity. Calculated Gibbs energies of binding obtained by molecular docking simulations were well correlated to the experimentally determined binding affinities of the investigated chiral esters. (doi: 10.5562/cca2060)
If you¡¯re interested in learning more about 1889-67-4. The above is the message from the blog manager. Application In Synthesis of (2,3-Dimethylbutane-2,3-diyl)dibenzene.
Reference:
Quinuclidine – Wikipedia,
,Quinuclidine | C7H13N | ChemSpider