Search results for "carbon-13"

showing 10 items of 283 documents

Corrosion inhibition performance of a structurally well-defined 1,2,3-triazole derivative on mild steel-hydrochloric acid interface

2021

Abstract In the present work, a new 1,4-disubstituted-1,2,3-triazole product, named 4-[1-(4-methoxy-phenyl)-1H-[1,2,3]triazol-4-ylmethyl]-morpholine (MPTM) was successfully synthesized under click chemistry regime. The structure of the new compound that has a rigid triazole moiety and a flexible morpholine ligand has been characterized using 1H NMR, 13C NMR, HRMS, and FTIR spectroscopy. Its inhibition performance for mild steel in acidic medium 1 M HCl has been studied by utilizing a combination of experimental, spectroscopic and computational methods. The electrochemical characterization was carried out by a gravimetric study, electrochemical impedance spectroscopy (EIS), and potentiodynam…

010405 organic chemistryOrganic ChemistryLangmuir adsorption modelCarbon-13 NMR010402 general chemistry01 natural sciences0104 chemical sciencesAnalytical ChemistryDielectric spectroscopyInorganic Chemistrysymbols.namesakechemistry.chemical_compoundAdsorptionchemistryMorpholinesymbolsProton NMRFourier transform infrared spectroscopySpectroscopyDerivative (chemistry)Nuclear chemistryJournal of Molecular Structure
researchProduct

A new ursane-type triterpene oxoglucopyranoside from Crossopteryx febrifuga.

2019

Abstract A new saponin, 3-O-β-d-3-oxo-glucopyranosyl-ursa-12,20(30)-diene-27,28-dioic acid (1), was isolated from the methanol extract of stem bark of Crossopteryx febrifuga together with the known 3β-d-glucopyranosyl-ursa-12,20(30)-diene-27,28-dioic acid (2), shanzhiside methyl ester (3), shanzhiside (4), β-sitosterol (5), β-sitosterol-3-O-β-d-glucopyranoside (6), ursa-12,20(30)-diene-27,28-dioic acid (7), hederagenin (8), and oleanolic acid (9). The structures were established by comprehensive interpretation of their spectral data 1D- (1H and 13C), 2D-NMR (1H-1H COSY, HMQC, HMBC), spectroscopic, and electrospray ionisation time-of-flight mass spectrometry analysis. The isolated compounds …

0106 biological sciencesProton Magnetic Resonance SpectroscopySaponinRubiaceaeMicrobial Sensitivity Testsmedicine.disease_cause01 natural sciencesGeneral Biochemistry Genetics and Molecular BiologyEnterococcus faecalischemistry.chemical_compoundMinimum inhibitory concentrationTriterpeneGlucosidesmedicineCarbohydrate ConformationCarbon-13 Magnetic Resonance SpectroscopyOleanolic acidchemistry.chemical_classificationChromatographybiologyBacteriaChemistrybiology.organism_classificationTriterpenes0104 chemical sciences010404 medicinal & biomolecular chemistryHederageninStaphylococcus aureusAntibacterial activity010606 plant biology & botanyZeitschrift fur Naturforschung. C, Journal of biosciences
researchProduct

2021

Centaurothamnus maximus (family Asteraceae), is a leafy shrub indigenous to the southwestern Arabian Peninsula. With a paucity of phytochemical data on this species, we set out to chemically characterize the plant. From the aerial parts, two newly identified guaianolides were isolated: 3β-hydroxy-4α(acetoxy)-4β(hydroxymethyl)-8α-(4-hydroxy methacrylate)-1αH,5αH, 6αH-gual-10(14),11(13)-dien-6,12-olide (1) and 15-descarboxy picrolide A (2). Seven previously reported compounds were also isolated: 3β, 4α, 8α-trihydroxy-4-(hydroxymethyl)-lαH, 5αH, 6βH, 7αH-guai-10(14),11(13)-dien-6,12-olide (3), chlorohyssopifolin B (4), cynaropikrin (5), hydroxyjanerin (6), chlorojanerin (7), isorhamnetin (8), …

0106 biological sciencesbiologyStereochemistryOrganic ChemistryPharmaceutical ScienceDEPTAsteraceaeFast atom bombardmentCarbon-13 NMRSesquiterpenebiology.organism_classification01 natural sciences0104 chemical sciencesAnalytical Chemistry010404 medicinal & biomolecular chemistrychemistry.chemical_compoundchemistryChemistry (miscellaneous)Drug DiscoveryMolecular MedicineHydroxymethylPhysical and Theoretical ChemistryTwo-dimensional nuclear magnetic resonance spectroscopyIsorhamnetin010606 plant biology & botanyMolecules
researchProduct

Biocatalytic hydrogenation of the C=C bond in the enone unit of hydroxylated chalcones-process arising from cyanobacterial adaptations.

2018

To verify the hypothesis that cyanobacteria naturally biosynthesising polyphenolic compounds possess an active enzymatic system that enables them to transform these substances, such an ability of the biocatalytic systems of whole cells of these biota was assessed for the first time. One halophilic strain and seven freshwater strains of cyanobacteria representing four of the five taxonomic orders of Cyanophyta were examined to determine the following: (i) whether they contain polyphenols, including flavonoids; (ii) the resistance of their cultures when suppressed by the presence of exogenous hydroxychalcones—precursors of flavonoid biosynthesis and (iii) whether these photoautotrophs can tra…

0301 basic medicineCyanobacteriaStereochemistryHydroxylated chalconesCyanobacteria01 natural sciencesApplied Microbiology and BiotechnologyHydroxylation03 medical and health scienceschemistry.chemical_compoundChalconesbiology010405 organic chemistryfood and beveragesGeneral MedicineCarbon-13 NMRbiology.organism_classification0104 chemical sciencesRegiospecific hydrogenation030104 developmental biologyFlavonoid biosynthesisApplied Microbial and Cell PhysiologychemistryPolyphenolBiocatalysisProton NMRBiocatalysisHydrogenationEnoneBiotechnologyApplied microbiology and biotechnology
researchProduct

Bistacrine derivatives as new potent antimalarials

2016

Linking two tacrine molecules results in a tremendous increase of activity against Plasmodia in comparison to the monomer. This finding prompted the synthesis of a library of monomeric and dimeric tacrine derivatives in order to derive structure-activity relationships. The most active compounds towards chloroquine sensitive Plasmodium strain 3D7 and chloroquine resistant strain Dd2 show IC50 values in the nanomolar range of concentration, low cytotoxicity and target the cysteine protease falcipain-2, which is essential for parasite growth.

0301 basic medicinePlasmodiumSpectrometry Mass Electrospray IonizationStereochemistryProton Magnetic Resonance SpectroscopyClinical BiochemistryPharmaceutical Science01 natural sciencesBiochemistryAntimalarialsInhibitory Concentration 50Structure-Activity Relationship03 medical and health scienceschemistry.chemical_compoundChloroquineResistant strainDrug DiscoverymedicineAnimalsStructure–activity relationshipCarbon-13 Magnetic Resonance SpectroscopyCytotoxicityMolecular BiologyStrain (chemistry)010405 organic chemistryOrganic ChemistryCysteine protease0104 chemical sciences030104 developmental biologyMonomerchemistryBiochemistryTacrineTacrineMolecular MedicineDimerizationmedicine.drugBioorganic & Medicinal Chemistry
researchProduct

Synthesis, characterization, and cytotoxic activity of copper(II) and platinum(II) complexes of 2-benzoylpyrrole and X-ray structure of bis[2-benzoyl…

2004

Copper(II) and platinum(II) complexes of 2-benzoylpyrrole (2-BZPH) were synthesized and characterized with IR, 1 H and 1 3 C NMR spectroscopies and coordination geometry with ligands arranged in transoid fashion. The crystal structure of [Cu I I (2-BZP) 2 ] was determined by X-ray diffraction. Death of complex treated Jurkat cells was measured by flow cytometry. The bis-chelate complexes [Cu I I (2-BZP) 2 ] and [Pt I I (2-BZP) 2 ] adopt square-planar coordination geometry with ligands, arranged in transoid fashion. Concentrations of 1-10 μM Platinum(II) complexes reduced cell survival from 100% to 20%, in contrast to the copper(II) complex which caused no cell death at a concentration of 10…

2-BenzoylpyrroleCopper(II) and platinum(II) complexesCytotoxicityMagnetic Resonance SpectroscopySpectrophotometry InfraredCell SurvivalMolecular Conformationchemistry.chemical_elementAntineoplastic AgentsCrystal structureCrystallography X-RayLigandsBiochemistryJurkat cellsInorganic ChemistryJurkat CellsOrganometallic CompoundsHumansPyrrolesCytotoxicityCoordination geometryPlatinumFormazansCell DeathDose-Response Relationship DrugMolecular StructureX-rayHydrogen Bonding2-benzoylpyrrole; copper(ii) and platinum(ii) complexes; cytotoxicityCarbon-13 NMRFlow CytometryCopperCrystallographycopper(ii) and platinum(ii) complexeschemistryxray cristallogrphycytotoxicityIndicators and ReagentsPlatinumCopper2-benzoylpyrroleJournal of inorganic biochemistry
researchProduct

Synthesis of Rosmarinic Acid Amides as Antioxidative and Hypoglycemic Agents

2019

Type 2 diabetes mellitus (T2DM) is an important metabolic disorder for which there is an urgent need for new antidiabetic drugs. α-Glucosidase inhibition is an established protocol for T2DM therapy. Because hyperglycemia causes oxidative tissue damage, the development of agents with both α-glucosidase inhibition and antioxidant activity from natural or natural-derived polyphenols such derivatives of rosmarinic acid (RA) represents an attractive therapeutic option. We report a study on amides 1-10 derived from RA and their evaluation for yeast α-glucosidase inhibition and antioxidant activity (DPPH and ORAC tests). All amides showed higher inhibitory activity than that of RA, were by far mor…

3003DrugAntioxidantDPPHProton Magnetic Resonance Spectroscopymedia_common.quotation_subjectmedicine.medical_treatmentPharmaceutical ScienceOxidative phosphorylationPharmacologyDepsides01 natural sciencesAntioxidantsAnalytical Chemistrychemistry.chemical_compoundDrug DiscoverymedicineHypoglycemic AgentsSettore BIO/15 - Biologia FarmaceuticaCarbon-13 Magnetic Resonance SpectroscopyIC50media_commonAcarbosePharmacology010405 organic chemistrydiabetes mellituDrug Discovery3003 Pharmaceutical ScienceRosmarinic acidOrganic ChemistrySettore CHIM/06 - Chimica OrganicaComplementary and Alternative Medicine2708 DermatologyAmidesamide0104 chemical sciences010404 medicinal & biomolecular chemistryRosmarinic acidComplementary and alternative medicinechemistryCinnamatesPolyphenolAnalytical Chemistry; Molecular Medicine; Pharmacology; 3003; Drug Discovery3003 Pharmaceutical Science; Complementary and Alternative Medicine2708 Dermatology; Organic ChemistryMolecular Medicineα-glucosidasemedicine.drug
researchProduct

Lanthanide–saccharide chemistry: synthesis and characterisation of Ce(III)–saccharide complexes

2000

A series of nine Ce(III) complexes has been synthesised with seven different monosaccharides (D-glucose, D-fructose, D-galactose, D-mannose, L-sorbose, D-ribose and D-xylose) and two different disaccharides (D-maltose and L-lactose), and these have been characterised with various analytical, spectral, magnetic and electrochemical techniques. The NMR studies have highlighted some interesting features about the metal-ion-binding pattern of the saccharides. Some additional coordination has been proposed along with the chelating groups in the saccharide molecules, based on the shifts in 13C NMR spectra. On the other hand, solution absorption studies and solid-state magnetic susceptibilities hav…

Absorption SpectraLanthanideMagnetic Resonance SpectroscopyStereochemistryMetal ions in aqueous solutionMannoseDisaccharidesBiochemistryAnalytical Chemistrychemistry.chemical_compoundSpectroscopy Fourier Transform InfraredElectrochemistryMonosaccharideOrganic chemistryMoleculeChelating Agentschemistry.chemical_classificationMolecular StructureSpectrometersCircular DichroismMetal IonsMonosaccharidesOrganic ChemistryElectric ConductivityElectron Spin Resonance SpectroscopyFructoseCeriumGeneral MedicineCarbon-13 NMRSorbosechemistrySpectrophotometryMetals Rare EarthElectrochemical AnalysisCarbohydrate Research
researchProduct

Carbon-13 chemical shifts of bicyclic compounds

1970

13C NMR absorption spectra of 50 bicyclic hydrocarbons, alcohols and ketones have been measured, in addition to some terpenes. The 13C chemical shifts are approximately additive for similar compounds and can be used for the determination of molecular structure; they differ for endo- and exo-isomers, just as in proton spectra. These quite regular and predictable 13C shift differences are much larger and are caused by the 1,4-nonbonded interaction between atoms heavier than hydrogen, not by magnetic anisotropy effects.

Absorption spectroscopyBicyclic moleculeHydrogenChemistryChemical shiftCarbon-13chemistry.chemical_elementGeneral ChemistryCarbon-13 NMRMagnetic anisotropyComputational chemistryOrganic chemistryMoleculeGeneral Materials ScienceOrganic Magnetic Resonance
researchProduct

Enantiodifferentiation of acyclic phosphonium salts in chiral liquid crystalline solutions

2006

Abstract The enantiodifferentiation of acyclic phosphonium salts bearing a stereogenic centre, whether on the phosphorus atom or on one of its substituents, was investigated by 2 H–{ 1 H}, 13 C–{ 1 H} and 31 P–{ 1 H} NMR in chiral liquid crystals composed of a polypeptide dissolved in an organic solvent. For the first time, the enantiomers of P-chirogenic phosphorus compounds were discriminated in these anisotropic media, affording good to excellent separation of the signals, allowing the determination of their proportion. While 31 P–{ 1 H} NMR spectra showed no chiral separation, 2 H–{ 1 H} NMR was efficient in the enantiodifferentiation of an isotopically labelled compound. Better still, …

Alternative methodsChemistryLiquid crystallineOrganic ChemistryCarbon-13 NMRCatalysisStereocenterInorganic ChemistryNMR spectra databasechemistry.chemical_compoundCrystallographyLiquid crystalOrganic chemistryPhosphoniumPhysical and Theoretical ChemistryEnantiomerTetrahedron: Asymmetry
researchProduct