An Integrated Molecular Networking and Docking Approach to Characterize the Metabolome of and Its Pharmaceutical Potentials.

South Africa is rich in diverse medicinal plants, and it is reported to have over 35% of the global species, many of which are utilized in traditional medicine. Various phytochemical studies have offered valuable insights into the chemistry of plants, hinting at bioactive components that define the medicinal properties of the plant. However, there are still knowledge gaps regarding the size and diversity of the chemical space.