13 C and 1 H NMR signal assignments of some new synthetic dehydroabietic acid derivatives

2008 ◽  
Vol 46 (4) ◽  
pp. 381-386 ◽  
Author(s):  
Marinaldo S. de Carvalho ◽  
Lúcia H. B. Baptistella ◽  
Paulo M. Imamura
Keyword(s):  
Dehydroabietic Acid ◽  
H Nmr

Synthesis and fungicidal activity of dehydroabietyl-1,2,4-triazolo-thiazolidinones

Holzforschung ◽  
2013 ◽  
Vol 67 (1) ◽  
pp. 107-112 ◽  
Author(s):  
Xue-Tang Xu ◽  
Xian-Li Ma ◽  
Wen-Gui Duan ◽  
Li Chen ◽  
Bo Cen ◽  
...  
Keyword(s):  
Fusarium Graminearum ◽  
Elemental Analysis ◽  
Fungicidal Activity ◽  
Condensation Reaction ◽  
Alternaria Solani ◽  
Aromatic Aldehydes ◽  
Dehydroabietic Acid ◽  
Cercospora Arachidicola ◽  
H Nmr ◽  
C Nmr

Abstract In search of novel potent bioactive compounds, a series of novel dehydroabietic acid derivatives bearing 1,2,4-triazolo-thiazolidinone moieties were designed and synthesized. Seven compounds were synthesized of the type 6-substituted benzylidene-3-dehydroabietyl-thiazolo[2,3-c][1,2,4]triazol-5-ones. To this purpose a condensation reaction was performed with 3-dehydroabietyl-thiazolo[2,3-c][1,2,4]triazol-5-one and various aromatic aldehydes. All the title compounds were analyzed and characterized by means of IR, MS, 1H NMR, 13C NMR, and elemental analysis. A preliminary bioassay showed that, at a concentration of 50 μg ml-1, the target compounds exhibited the best fungicidal activity against Fusarium graminearum (F. graminearum) of the five fungi tested (F. oxysporum f. cucumerinum, Alternaria solani, Physalospora piricola, Cercospora arachidicola, and F. graminearum).

scholarly journals Synthesis and Antibacterial Activity of C-7 Acylhydrazone Derivatives of Dehydroabietic Acid

2018 ◽  
Vol 42 (8) ◽  
pp. 405-407 ◽  
Author(s):  
Zhi Zhou ◽  
Tingting Zhou
Keyword(s):  
Antibacterial Activity ◽  
Antibacterial Activities ◽  
Dehydroabietic Acid ◽  
Diffusion Method ◽  
Aromatic Acids ◽  
Substitution Reactions ◽  
Disk Diffusion Method ◽  
H Nmr ◽  
Benzylic Oxidation ◽  
Derivatives Of

Seven new C-7 acylhydrazone derivatives of dehydroabietic acid were synthesised from dehydroabietic acid through benzylic oxidation, condensation with hydrazine hydrate, followed by nucleophilic substitution reactions with a variety of substituted aromatic acids. The structures of the synthesised compounds were characterised by IR, 1H NMR and MS. The antibacterial activities of the synthesised compounds were evaluated by the disk diffusion method. Antibacterial activity studies showed that C-7 acylhydrazone derivatives of dehydroabietic acid exhibited inhibitory activities against Escherichia coli, Staphylococcus aureus and Bacillus subtilis. Among the seven compounds, dehydroabietic acid p-fluorobenzoyl hydrazone showed the strongest inhibitory activity against B. subtilis and S. aureus.

Synthesis and herbicidal activity of 5-dehydroabietyl-1,3,4-oxadiazole derivatives

Holzforschung ◽  
2011 ◽  
Vol 65 (2) ◽  
Author(s):  
Wen-Gui Duan ◽  
Xing-Ren Li ◽  
Qi-Jin Mo ◽  
Jian-Xin Huang ◽  
Bo Cen ◽  
...  
Keyword(s):  
Alkyl Halide ◽  
Dehydroabietic Acid ◽  
Herbicidal Activity ◽  
Barnyard Grass ◽  
H Nmr ◽  
Benzyl Halide ◽  
Excellent Growth ◽  
Oxadiazole Derivatives ◽  
Almost All ◽  
Therapeutic Compounds

Abstract To search for novel therapeutic compounds with higher activity, a series of novel dehydroabietic acid derivatives bearing 1,3,4-oxadiazole moieties were designed and synthesized. Ten title compounds 5-dehydroabietyl-2-alkyl thio-1,3,4-oxadiazoles were synthesized by the reaction of 5-dehydroabietyl-2-mercapto-1,3,4-oxadiazole with alkyl halide or substituted benzyl halide in ethanolic KOH. All the title compounds were analyzed and characterized by means of IR, UV-vis, EI-MS, 1H-NMR, 13C-NMR, and elemental analysis. The preliminary herbicidal assay showed that almost all of the compounds exhibited an excellent growth inhibition to rape (Brassica campestris) and a certain inhibition to barnyard grass (Echinochloa crusgalli L.) at a concentration of 100 μg ml-1.

Das Verhalten der Körpermasse bei einem 81-jährigen Läufer an einem 100-km-Lauf

Praxis ◽  
2009 ◽  
Vol 98 (3) ◽  
pp. 143-149 ◽  
Author(s):  
Knechtle ◽  
Wirth ◽  
Knechtle ◽  
Kohler
Keyword(s):  
H Nmr

Ein 81-jähriger Läufer mit Status nach aortokoronarem Bypass bei bekannter koronarer Herzkrankheit hat einen 100-km-Lauf in 19 h und 45 min erfolgreich beendet. Vor und unmittelbar nach dem Lauf wurden Fett- und Muskelmasse nicht-invasiv sowohl mit der bioelektrischen Impedanzanalyse als auch mit der klassischen Hautfaltenmethode bestimmt. Zusätzlich wurden Blut- und Urinproben zur Beurteilung des Flüssigkeitshaushaltes genommen und eine ¹H-NMR-Spektroskopie des Urins zum Nachweis eines erhöhten Kohlenhydrat-, Fett- oder Eiweissstoffwechsels durchgeführt. Das Körpergewicht nahm um 1.9 kg ab. Während die errechnete Muskelmasse um 0.1 kg zunahm, nahm die errechnete Fettmasse um 0.2 kg (anthropometrische Methode) resp. 3.1 kg (BIA) ab. Das errechnete Körperwasser nahm um 1.2 l zu. Während Hämatokrit, Harnstoff und spezifisches Gewicht des Urins zunahmen, sank das Natrium im Blut ab. Das Plasmavolumen nahm um 19% ab. Die ¹H-NMR-Spektroskopie des Urins zeigte nach der Belastung einen Anstieg der Ketonkörper. Um einen Abbau der Muskelmasse objektivieren zu können, muss der Ausgangswert des Körperwassers abgewartet werden, um keine Fehlinterpretation aufgrund der Methoden zu machen. Unklar bleibt, wieso es zu einer Einlagerung von Wasser kam. In weiteren Untersuchungen könnten zusätzliche Methoden wie DEXA, Muskelbiopsien und Bestimmung von weiteren Blut- und Urinparametern Auskunft geben, ob effektiv und wie viel Muskelmasse abgebaut wird und ob Abbauprodukte der Muskulatur die Nierenfunktion einschränken und somit zu einer Wasserretention führen.

H NMR Evidence for a Change in The Local Hydrogen Environment of Sites Associated with the Staebler-Wronski Effect in a-Si:H

2002 ◽  
Vol 715 ◽  
Author(s):  
T. Su ◽  
Robin Plachy ◽  
P. C. Taylor ◽  
S. Stone ◽  
G. Ganguly ◽  
...  
Keyword(s):  
Line Shape ◽  
Defect Density ◽  
Hydrogen Atoms ◽  
Hydrogen Environment ◽  
H Nmr ◽  
Line Shapes ◽  
Different Temperatures ◽  
Staebler Wronski Effect

AbstractWe study the H NMR line shapes of a sample of a-Si:H under several conditions: 1) as grown, 2) light-soaked for 600 hours, and 3) light-soaked followed by annealing at different temperatures. At T = 7 K, the NMR line shape of the sample after light soaking exhibits an additional doublet compared to that of the sample as-grown. This doublet is an indication of a closely separated hydrogen pair. The distance between the two hydrogen atoms is estimated to be about (2.3 ± 0.2) Å. The concentration of these hydrogen sites is estimated to be between 1017 and 1018 cm-3 consistent with ESR measurements of the defect density after light soaking. This doublet disappears after the sample is annealed at 200°C for 4 hours.

Solvent-Ligand Interactions in Colloidal Nanocrystals

2018 ◽  
Author(s):  
Jonathan De Roo ◽  
Nuri Yazdani ◽  
Emile Drijvers ◽  
Alessandro Lauria ◽  
Jorick Maes ◽  
...  
Keyword(s):  
Direct Method ◽  
Line Broadening ◽  
H Nmr ◽  
Size Dependent ◽  
Line Shape Analysis ◽  
Wide Range ◽  
Nanocrystal Synthesis ◽  
Ligand Interactions ◽  
Indispensable Tool ◽  
Theoretical Evidence

<p>Although solvent-ligand interactions play a major role in nanocrystal synthesis, dispersion formulation and assembly, there is currently no direct method to study this. Here we examine the broadening of <sup>1</sup>H NMR resonances associated with bound ligands, and turn this poorly understood descriptor into a tool to assess solvent-ligand interactions. We show that the line broadening has both a homogeneous and a heterogeneous component. The former is nanocrystal-size dependent and the latter results from solvent-ligand interactions. Our model is supported by experimental and theoretical evidence that correlates broad NMR lines with poor ligand solvation. This correlation is found across a wide range of solvents, extending from water to hexane, for both hydrophobic and hydrophilic ligand types, and for a multitude of oxide, sulfide and selenide nanocrystals. Our findings thus put forward NMR line shape analysis as an indispensable tool to form, investigate and manipulate nanocolloids.</p>

Enantioselective Recognition of Chiral Guests by the Water-Soluble Chiral Keplerate {Mo132} Spherical Capsule with 30 Inner Lactate Ligands

2019 ◽  
Author(s):  
Nancy Watfa ◽  
Weimin Xuan ◽  
Zoe Sinclair ◽  
Robert Pow ◽  
Yousef Abul-Haija ◽  
...  
Keyword(s):  
Aqueous Solution ◽  
Chiral Recognition ◽  
Association Constants ◽  
Water Soluble ◽  
Enantioselective Recognition ◽  
H Nmr ◽  
Dosy Nmr ◽  
Spherical Capsule ◽  
Surface Pores ◽  
Guest Chemistry

Investigations of chiral host guest chemistry are important to explore recognition in confined environments. Here, by synthesizing water-soluble chiral porous nanocapsule based on the inorganic metal-oxo Keplerate-type cluster, {Mo<sub>132</sub>} with chiral lactate ligands with the composition [Mo<sub>132</sub>O<sub>372</sub>(H<sub>2</sub>O)<sub>72</sub>(<i>x-</i>Lactate)<sub>30</sub>]<sup>42-</sup> (<i>x</i> = D or L), it was possible to study the interaction with a chiral guest, L/D-carnitine and (<i>R</i>/<i>S</i>)-2-butanol in aqueous solution. The enantioselective recognition was studied by quantitative <sup>1</sup>H NMR and <sup>1</sup>H DOSY NMR which highlighted that the chiral recognition is regulated by two distinct sites. Differences in the association constants (K) of L- and D-carnitine, which, due to their charge, are generally restricted from entering the interior of the host, are observed, indicating that their recognition predominantly occurs at the surface pores of the structure. Conversely, a larger difference in association constants (K<i><sub>S</sub></i>/K<i><sub>R</sub></i> = 3) is observed for recognition within the capsule interior of (<i>R</i>)- and (<i>S</i>)-2-butanol.

Effects of Saccharomyces Cerevisiae Strains on Chemical Profiles of Cabernet Sauvignon Wines: Based on the Combined Results of 1H NMR, HS-SPME/GC-MS and HPLC-DAD-ESI-MS/MS

2018 ◽  
Vol 18 (2) ◽  
pp. 115-131
Author(s):  
Liang Heng-Yu ◽  
Su Ning ◽  
Guo Kun ◽  
Wang Yuan ◽  
Yang De-Yu
Keyword(s):  
Saccharomyces Cerevisiae ◽  
Principal Component ◽  
Grape Juice ◽  
Pilot Scale ◽  
Ethyl Esters ◽  
Cabernet Sauvignon ◽  
Esi Ms ◽  
H Nmr ◽  
Chemical Profiles ◽  
Indigenous Yeasts

Five Saccharomyces cerevisiae strains (Chinese indigenous yeasts SC5, WC5, SC8, CC17 and commercial starter F15) were inoculated into Cabernet sauvignon grape must and fermented at pilot scale. For the first time, combination of 1H NMR, HS-SPME/GC-MS and HPLC-DAD-ESI-MS/MS metabonomic profiling techniques was performed to analyze the global chemical fingerprints of sampled wines at the end of alcoholic and malolactic fermentation respectively, then 13 non-volatile flavor compounds, 52 volatile organic aromas and 43 polyphenolic molecules were identified and determined correspondently. All principal component analysis (PCA) of two fermentation stages based on the analytical results of 1H NMR, HS-SPME/GC-MS and HPLC-DAD-ESI-MS/MS divided these strains into three clusters: (1) SC5 and SC8, (2) WC5 and F15 and (3) CC17. The wine fermented by indigenous yeast, CC17, showed a very unique chemical profile, such as low pH and high color intensity, reduced amino acids (including proline) and the lowest total higher alcohols levels, most of the fixed acids, glycerol, ethyl esters and anthocyanins concentrations. The statistical results indicate that CC17 strain possesses very special anabolism and catabolism abilities on such substances in grape juice and has potentiality to produce characteristic wines with high qualities.

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