Germacrene D Cyclization: An Ab Initio Investigation

Essential oils that contain large concentrations of germacrene D are typically accompanied by cadinane sesquiterpenoids. The acid-catalyzed cyclization of germacrene D to give cadinane and selinane sesquiterpenes has been computationally investigated using both density functional (B3LYP/6-31G*) and post Hartree-Fock (MP2/6-31G* *) ab initio methods. The calculated energies are in general agreement with experimentally observed product distributions, both from acid-catalyzed cyclizations as well as distribution of the compounds in essential oils

Chemotyping and Determination of Antimicrobial, Insecticidal, and Cytotoxic Properties of Wild-Grown Cannabis sativa from Nepal

Cannabis sativa was collected from a wildgrowing population in Biratnagar, Nepal. The essential oil was obtained by hydrodistillation and analyzed by gas chromatography – mass spectrometry. A total of 107 constituents were identified in the oil accounting for 94.2% of the composition. This Nepalese chemotype is characterized by a predominance of sesquiterpenoids (68.1%) dominated by (E)-caryophyllene (20.4%), α-humulene (7.0%), and α-bisabolol (5.8%), but a paucity of monoterpene hydrocarbons (0.9%). In particular, neither myrcene nor terpinolene were detected. The oil in the Nepalese Cannabis plants did contain small amounts of cannabidiol (1.6%), cannabichromene (0.2%) and Δ9-tetrahydrocannabinol (0.4%). The essential oil from Nepalese Cannabis sativa was screened for antimicrobial, cytotoxic, larvicidal, and insecticidal activity, and it appears as though C. sativa is relatively non-toxic

Antiprotozoal Activity of Essential Oils

In the present scenario of protozoal infections, new drugs are urgently needed to treat and control infections such as malaria, sleeping sickness, Chagas disease, leishmaniasis and intestinal infections, which affect millions of people each year. In this review, we are focusing on articles related to antiprotozoal essential oils extracted from plants that have been published during the last 20 years. The data analyzed indicate that essential oils could be promising antiprotozoal agents, opening perspectives to the discovery of more effective drugs of vegetal origin for the treatment of diseases caused by protozoa

Tabebuia bahamensis: A Major Source of Pharmacologically Important Ursolic Acid

Leaves of Tabebuia bahamensis, collected on Abaco Island, Bahamas, were dried and extracted with dichloromethane to yield a crude extract. Using preparative flash column chromatography on silica gel, enabled the isolation of ursolic acid with an excellent yield of 2.06 percent based on the mass of dry leaves. Both the crude leaf extract and ursolic acid produced selective in-vitro cytotoxic activity on tumor cells from human mammary and bladder tissue. Ursolic acid also demonstrated antibacterial activity against Staphylococcus aureus

Attenuation of Cytotoxic Natural Product DNA Intercalating Agents by Caffeine

Many anti-tumor drugs function by intercalating into DNA. The xanthine alkaloid caffeine can also intercalate into DNA as well as form π-π molecular complexes with other planar alkaloids and anti-tumor drugs. The presence of caffeine could interfere with the intercalating anti-tumor drug by forming π-π molecular complexes with the drug, thereby blocking the planar aromatic drugs from intercalating into the DNA and ultimately lowering the toxicity of the drug to the cancer cells. The cytotoxic activities of several known DNA intercalators (berberine, camptothecin, chelerythrine, doxorubicin, ellipticine, and sanguinarine) on MCF-7 breast cancer cells, both with and without caffeine present (200 μg/mL) were determined. Significant attenuation of the cytotoxicities by caffeine was found. Computational molecular modeling studies involving the intercalating anti-tumor drugs with caffeine were also carried out using density functional theory (DFT) and the recently developed M06 functional. Relatively strong π–π interaction energies between caffeine and the intercalators were found, suggesting an “interceptor” role of caffeine protecting the DNA from intercalation

Antiprotozoal Activity of Essential Oils

In the present scenario of protozoal infections, new drugs are urgently needed to treat and control infections such as malaria, sleeping sickness, Chagas disease, leishmaniasis and intestinal infections, which affect millions of people each year. In this review, we are focusing on articles related to antiprotozoal essential oils extracted from plants that have been published during the last 20 years. The data analyzed indicate that essential oils could be promising antiprotozoal agents, opening perspectives to the discovery of more effective drugs of vegetal origin for the treatment of diseases caused by protozoa

Peppermint (Mentha piperita L.) essential oil as a potent anti-inflammatory, wound healing and anti-nociceptive drug

The present investigation was designed to study the chemical composition of Algerian peppermint essential oil (PEO) as well as the in vitro and in vivo anti-inflammatory, wound-healing and anti-nociceptive properties. Twenty-three compounds were identified in the PEO with the main chemical component as menthol (53.29%). Also, PEO showed a high content of oxygenated monoterpene compounds (92.75%). Topical application of PEO at doses of 200 and 20 µL/kg significantly reduced the acute ear edema in 38.09% and 36.50, respectively. Histological observation confirmed that PEO inhibited the skin inflammatory response. In-vivo wound healing activity of the cream prepared from PEO (0.5% w/w) was assessed by circular excision wound model followed by histological examination. The topical administration of PEO cream showed a significant decrease of unhealed wound area rate between the 6th (1.67±0.14 mm2) and the 9th (0.49±0.22 mm2) days of treatment when compared with the vehicle (2.32±0.77 mm2; p<0.05) and Madecassol® 0.1% creams (2.23±0.35 mm2; p<0.05). The PEO reduced nociceptive behavior at all doses tested in the acetic acid-induced nociception test (p<0.05). These findings support the anti-inflammatory, wound-healing and analgesic properties of PEO. We suggest that PEO is a promising candidate for use in skin care products with anti-inflammatory and wound-healing properties. DOI: http://dx.doi.org/10.5281/zenodo.383104