A critical review on the use of DP4+ in the structural elucidation of natural products: the good, the bad and the ugly. A practical guide

MO Marcarino, S Cicetti, MM Zanardi… - Natural Product …, 2022 - pubs.rsc.org
Covering: 2015 up to the end of 2020 Even in the golden age of NMR, the number of natural
products being incorrectly assigned is becoming larger every day. The use of quantum NMR …

Marine natural products

AR Carroll, BR Copp, RA Davis, RA Keyzers… - Natural product …, 2022 - pubs.rsc.org
Covering: 2020 This review covers the literature published in 2020 for marine natural
products (MNPs), with 757 citations (747 for the period January to December 2020) referring …

Structural characterisation of natural products by means of quantum chemical calculations of NMR parameters: New insights

FLP Costa, ACF de Albuquerque, RG Fiorot… - Organic Chemistry …, 2021 - pubs.rsc.org
In the early 2000s, the first articles regarding the calculation of NMR parameters for natural
products appeared in the literature. Since then, modelling 1H and 13C chemical shifts and …

Uncommon Diterpenoids from the South China Sea Soft Coral Sinularia humilis and Their Stereochemistry

LL Sun, WS Li, J Li, HY Zhang, LG Yao… - The Journal of …, 2021 - ACS Publications
The chemical investigation of the South China Sea soft coral Sinularia humilis has resulted
in the isolation of a library of diverse diterpenoids, including four new cembranoids, namely …

Sinusiaetone A, an Anti-inflammatory Norditerpenoid with a Bicyclo[11.3.0]hexadecane Nucleus from the Hainan Soft Coral Sinularia siaesensis

ZH Chen, WS Li, ZY Zhang, H Luo, JR Wang… - Organic …, 2021 - ACS Publications
A novel norditerpenoid, sinusiaetone A (1), featuring an uncommon bicyclo [11.3. 0]
hexadecane carbon skeleton, and four polyoxygenated cembranoids (2–5) were isolated …

Chemistry and bioactivity of secondary metabolites from South China Sea marine fauna and flora: Recent research advances and perspective

J Liu, Y Gu, M Su, Y Guo - Acta Pharmacologica Sinica, 2022 - nature.com
Marine organisms often produce a variety of metabolites with unique structures and diverse
biological activities that enable them to survive and struggle in the extremely challenging …

Cembranoids of soft corals: Recent updates and their biological activities

MY Nurrachma, D Sakaraga, AY Nugraha… - Natural Products and …, 2021 - Springer
Soft corals are well-known as excellent sources of marine-derived natural products. Among
them, members of the genera Sarcophyton, Sinularia, and Lobophytum are especially …

Cembrane diterpenoids: chemistry and pharmacological activities

N Zhang, W Xu, Y Yan, M Chen, H Li, L Chen - Phytochemistry, 2023 - Elsevier
Cembrane diterpenoids (cembranoids), characterized by a 14-membered carbon ring and
wide variety of functional groups, found in marine and terrestrial organisms. Many studies …

May the force (field) Be with you: On the importance of conformational searches in the prediction of NMR chemical shifts

C Cuadrado, AH Daranas, AM Sarotti - Marine Drugs, 2022 - mdpi.com
NMR data prediction is increasingly important in structure elucidation. The impact of force
field selection was assessed, along with geometry and energy cutoffs. Based on the …

Machine learning in computational NMR-aided structural elucidation

I Cortés, C Cuadrado, A Hernández Daranas… - Frontiers in Natural …, 2023 - frontiersin.org
Structure elucidation is a stage of paramount importance in the discovery of novel
compounds because molecular structure determines their physical, chemical and biological …