A Comprehensive Computational NMR Analysis of Organic Polyarsenicals including the Marine Sponge-Derived Arsenicins A–D and Their Synthetic Analogs
The adamantane structure of arsenicin A and nor-adamantane structures of arsenicins B–D have gained attention as unique natural polyarsenicals, as well as hits showing promising anticancer activity. The purpose of this study is to apply the predictive power of NMR DFT calculations in order to identi...
Main Authors: | Andrea Defant, Ines Mancini |
---|---|
Format: | Article |
Language: | English |
Published: |
MDPI AG
2023-09-01
|
Series: | Marine Drugs |
Subjects: | |
Online Access: | https://www.mdpi.com/1660-3397/21/10/511 |
Similar Items
-
Expanding the Chemical Space of Arsenicin A-C Related Polyarsenicals and Evaluation of Some Analogs as Inhibitors of Glioblastoma Stem Cell Growth
by: Jacopo Vigna, et al.
Published: (2023-03-01) -
DFT Calculations of <sup>31</sup>P NMR Chemical Shifts in Palladium Complexes
by: Svetlana A. Kondrashova, et al.
Published: (2022-04-01) -
Isolation and NMR Scaling Factors for the Structure Determination of Lobatolide H, a Flexible Sesquiterpene from <i>Neurolaena lobata</i>
by: Tibor Kovács, et al.
Published: (2023-03-01) -
NMR-Based Milk Metabolomics
by: Hanne C. Bertram, et al.
Published: (2013-04-01) -
A systems approach using OSMAC, Log P and NMR fingerprinting: An approach to novelty
by: Miaomiao Liu, et al.
Published: (2017-12-01)