Search results for "Nuclear Magnetic Resonance Spectroscopy"

showing 10 items of 843 documents

Antikonvulsiva, 1. Mitt. Thiocarbamoylbutyroguanamine

1986

Durch Anlagerung von Butyroguanamin (1) an die Isothiocyanate 2a-c sind die Thiocarbamoylbutyroguanamine 3a-c zuganglich. Auf dem Wege der Acylierung von 3 sind unsymmetrisch substituierte Butyroguanamine 4 erhaltlich. Unter den neu entwickelten Verbindungen zeichnet sich insbesondere 3c durch antikonvulsive, fungizide und die Magensauresekretion hemmende Wirkungen aus. Anticonvulsivic Agents, I: Thiocarbamoylbutyroguanamines The thiocarbamoylbutyroguanamines 3a-c are accessible by addition of butyroguanamine (1) to the isothiocyanates 2a-c. Unsymmetrically substituted butyroguanamines 4 are obtainable by acylation of 3. Among the newly prepared compounds, 3c in particular exhibits anticonv…

Acylationchemistry.chemical_compoundChemistryStereochemistryDrug DiscoveryIsothiocyanateMass spectrumPharmaceutical ScienceButyroguanamineNuclear magnetic resonance spectroscopyInhibitory effectArchiv der Pharmazie
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The identification of vicinally substituted cyclohexane isomers in their mixtures by 1H and 13C NMR spectroscopy.

2000

The radical addition reactions of organobromine compounds, XBr (X = CH2COOMe, PhCH2, CHBr2 and CCl3) with cyclohexene afforded mixtures of cis/trans isomer pairs of 1-X-2-Br-cyclohexanes. In addition to benzyl benzoyloxy derivatives are formed also, when benzoyl peroxide is used as an initiator. Owing to the great difficulties in separating these cis/trans isomer pairs, they are identified directly in their mixtures by NMR spectroscopy. In addition to one-dimensional (ID) 1H, proton decoupled 13C and DEPT-135, also two-dimensional (2D) 13C-13C INADEQUATE as well as 1H-13C HMQC experiments have been used in assigning the signals of each compound in their mixtures. The identification of each …

Addition reactionCarbon IsotopesMagnetic Resonance SpectroscopyCyclohexaneStereochemistryCyclohexeneMolecular ConformationStereoisomerismStereoisomerismBenzoyl peroxideNuclear magnetic resonance spectroscopyTritiumMedicinal chemistryAtomic and Molecular Physics and OpticsAnalytical Chemistrychemistry.chemical_compoundchemistryCyclohexanesmedicineMolecular orbitalInstrumentationSpectroscopyCis–trans isomerismmedicine.drugSpectrochimica acta. Part A, Molecular and biomolecular spectroscopy
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Metabolite identification in human liver needle biopsies by high-resolution magic angle spinning1H NMR spectroscopy

2006

High-resolution magic angle spinning (HR-MAS) 1 H NMR spectroscopy of intact human liver needle biopsies has not been previously reported. HR-MAS NMR spectra collected on 17 specimens with tissue amounts between � 0.5 and 12 mg showed very good spectral resolution and signal-to-noise ratios. One-dimensional 1 H spectra revealed many intense signals corresponding to cellular metabolites. In addition, some high molecular weight metabolites, such as glycogen and mobile fatty acids, could be observed in some spectra. Resonance assignments for 22 metabolites were obtained by combining the analysis of three different types of 1D 1 H spectral editing, such as T2 filtering or the nuclear Overhauser…

AdultLiver CirrhosisMaleMagnetic Resonance SpectroscopyMetaboliteNuclear Overhauser effectSensitivity and Specificitychemistry.chemical_compoundNuclear magnetic resonanceMagic angle spinningHumansRadiology Nuclear Medicine and imagingSpectroscopySpectroscopyAgedHepatitis ChronicChemistryBiopsy NeedleReproducibility of ResultsResonanceNuclear magnetic resonance spectroscopyMiddle AgedNMR spectra databaseProton NMRMolecular MedicineFemaleSpin Labelslipids (amino acids peptides and proteins)ProtonsBiomarkersNMR in Biomedicine
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MRS SHOWS ABNORMALITIES BEFORE SYMPTOMS IN FAMILIAL ALZHEIMER DISEASE

2006

Background: Pathologic change in Alzheimer disease (AD) begins some years before symptoms. MRS has the potential to detect metabolic abnormalities reflecting this early pathologic change. Presenilin 1 (PS1) and amyloid precursor protein (APP) mutation carriers have a nearly 100% risk of developing AD and may be studied prior to symptom onset. Methods: Short echo time proton MR spectra were acquired from a midline posterior cingulate voxel in presymptomatic carriers of PS1 or APP mutations (“presymptomatic mutation carriers” [PMCs]; n = 7) and age- and sex-matched control subjects (n = 6). Ratios of N-acetyl aspartate (NAA), myo-inositol (MI), and choline-containing compounds (Cho) to creati…

AdultMalemedicine.medical_specialtyPathologyMagnetic Resonance SpectroscopyAlzheimer disease brain metabolism nuclear magnetic resonance spectroscopyAdolescentNeuropsychological TestsCreatineGastroenterologyPresenilinCentral nervous system diseasechemistry.chemical_compoundDegenerative diseaseAlzheimer DiseaseReference ValuesInternal medicinemental disordersmedicineHumansFamilySymptom onsetAge of OnsetChildSettore M-PSI/02 - Psicobiologia E Psicologia FisiologicaBrainInfantMiddle Agedmedicine.diseaseControl subjectsnervous system diseasesnervous systemchemistryChild PreschoolCarrier StateFemaleNeurology (clinical)Alzheimer's diseaseGeometric meanPsychology
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Differential Effects of Dry Eye Disorders on Metabolomic Profile by 1H Nuclear Magnetic Resonance Spectroscopy

2014

We used1H NMR spectroscopy to analyze the metabolomic profile of reflex tears from patients with dry eye disorders (DEDs). 90 subjects were divided into 2 groups: (1) patients with DEDs (DEDG;n = 55) and (2) healthy subjects (CG;n = 35). Additionally, the DEDG was subdivided into 2 subgroups based on DED severity: mild-to-moderate and moderate (n = 22andn = 33, resp.). Personal interviews and systematized ophthalmologic examinations were carried out. Reflex tears (20–30 μL) were collected by gently rubbing in the inferior meniscus of both eyelids with a microglass pipette and stored at −80°C until analysis. NMR spectra were acquired using a standard one-dimensional pulse sequence with water…

AdultMalemedicine.medical_specialtyPathologyMagnetic Resonance SpectroscopyArginineArticle Subjectlcsh:MedicineCreatineGeneral Biochemistry Genetics and Molecular Biologychemistry.chemical_compoundMetabolomicsOphthalmologymedicineCholineHumansAgedAged 80 and overGeneral Immunology and Microbiologybusiness.industrylcsh:RPulse sequenceGeneral MedicineNuclear magnetic resonance spectroscopyMiddle AgedchemistryTearsReflexMetabolomeTearsDry Eye SyndromesFemalebusinessResearch ArticleBioMed Research International
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Histaminanaloge, 27. Mitt. Bis (2,2′-histamine)

1985

Es wurden p-Phenylen-bis(2,2′-histamin) (6a), Ethylen-bis(2,2′-histamin) (6b), Tetramethylen-bis(2,2′-histamin) (6c) und Hexamethylen-bis(2,2′-histamin) (6d) dargestellt und auf Histamin-H1-und H2-agonistische Aktivitat untersucht. Histamine Analogues, XXVII: Bis(2,2′-histamines) p-Phenylenebis(2,2′-histamine) (6a), ethylenebis(2,2′-histamine) (6b), tetramethylenebis(2,2′-histamine) (6c), and hexamethylenebis(2,2′-histamine) (6d) were prepared and tested for histamine H1,-and H2-agonistic activity.

Agonistchemistry.chemical_compoundmedicine.drug_classStereochemistryChemistryDrug DiscoverymedicinePharmaceutical ScienceBiological activityNuclear magnetic resonance spectroscopyHistamineArchiv der Pharmazie
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The first sorbicillinoid alkaloids, the antileukemic sorbicillactones A and B, from a sponge-derived Penicillium chrysogenum strain

2005

The saltwater culture of a Penicillium chrysogenum strain isolated from the Mediterranean sponge Ircinia fasciculata yielded three new sorbicillin-derived compounds (1-3), whose structures were elucidated mainly by 2D NMR and mass spectrometry. Among them, sorbicillactones A (1) and B (2) are the first sorbicillinoid natural products that contain nitrogen. Compound 1 is anti-HIV active and it exhibits a strong cytotoxic activity against L5178y leukemic cells, combined with a relatively low toxicity to cervical carcinoma HeLa S3 cells and pheochromocytoma PC 12 cells. The absolute configurations of I and 2 were elucidated by quantum chemical calculation of circular dichroism (CD) spectra. An…

AlanineCircular dichroismMethionineStrain (chemistry)biology010405 organic chemistryStereochemistryOrganic Chemistry010402 general chemistryMass spectrometryPenicillium chrysogenumbiology.organism_classification01 natural sciencesBiochemistry3. Good health0104 chemical scienceschemistry.chemical_compoundSpongechemistryBiochemistryDrug DiscoveryTwo-dimensional nuclear magnetic resonance spectroscopyTetrahedron
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Pitfalls to be considered on the metabolomic analysis of biological samples by HR-MAS

2014

HR-MAS (High-Resolution Magic AngleSpinning) is considered a powerfultechnique for metabolomic studies ofbiological samples that provides “intact”tissue spectra (Cheng et al., 1998; Waterset al., 2000; Sitter et al., 2002; Martinez-Bisbal et al., 2004; Payne et al., 2006;Coen et al., 2007; Bathen et al., 2010).The performance of HR-MAS, fol-lowed by quantitative histopathology hasdemonstrated that, despite some changes,HR-MAS can preserve approximately thetissue histopathologic features producingwell-resolved spectra of cellular metabo-lites (Cheng et al., 2000). Nevertheless,therearesomeaspectsarousedintheliter-ature about the possible biochemical andstructural changes that can occur durin…

Alaninechemistry.chemical_classificationChemistryERETICMetabolomics/metabolite profilingGeneral ChemistryNuclear magnetic resonance spectroscopyOpinion ArticleBioinformaticsmedicine.diseaseAmino acidlcsh:ChemistryChemistryBiological samplesNMR spectroscopyMetabolomicslcsh:QD1-999BiochemistryOsmolyteValineHR-MAS NMRmedicineIsoleucineCell damageFrontiers in Chemistry
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Synthesis, characterization of diorganotin(IV) complexes of N-(2-hydroxyarylidene)aminoacetic acid and antitumour screening in vivo in ehrlich ascite…

2001

Some new diorganotin(IV) complexes have been prepared by reacting potassium N-(2-hydroxyarylidene)aminoacetate with R2SnCl2(R = Me,nBu,Ph). The complexes have been characterized by 1H,13C,119Sn NMR, IR and 119mSn Mössbauer spectroscopic techniques in combination with elemental analysis. In the solid state, the complexes possess penta- and hexa-coordinated tin centres. The hexa-coordinated tin complexes were found to dissociate in solution, giving rise to penta-coordinated species as revealed by 119Sn NMR spectroscopy. Antitumour screening in vivo of the complexes L4snPh2,L4SnPh2· Ph3SnCl and L4SntBU2·t Bu2SnCl2 (L4 = N-(2-hydroxyacetophenone)aminoacetate) is also reported. Copyright © 2001 …

AldiminesynthesisStereochemistryMossbauer spectroscopyInfrared spectroscopyAntitumour activityanimal cellantineoplastic activitydissociationChemical synthesisMedicinal chemistryEhrlich ascites tumor cellEhrlich ascites carcinomaInorganic Chemistryin vivo studychemistry.chemical_compoundAcetic acidOrganotinmalecomplex formationorganotin compoundcontrolled studyCarboxylateinfrared spectroscopyEhrlich ascites carcinoma cellmouseglycine derivativenuclear magnetic resonance spectroscopychemistry.chemical_classificationSchiff basenonhumananimal modelarticleGeneral ChemistryNuclear magnetic resonance spectroscopysolid stateNMRAmino acidchemistryreaction analysiSettore CHIM/03 - Chimica Generale E InorganicaIRSchiff baseschemical analysi
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H2-Antihistaminika, 36. Mitt. Isolamtidin und Analoge

1987

Isolamtidin (9a), ein Stellungsisomer des Lamtidins (8a), sowie die analogen N3-substituierten 1-Methyl-1H-1,2,4-triazol-3,5-diamine 9e-i, k wurden durch spezifische Synthese dargestellt und am isolierten Meerschweinchenvorhof und an der histaminstimulierten Sauresekretion der narkotisierten Ratte auf H2-antagonistische Wirkung untersucht. H2-Antihistaminics, XXXVI: Isolamitidine and Analogues Isolamitidine (9a), a position isomer of lamtidine (8a), as well as the analogous N3-substituted 1-methyl-1H-1,2,4-triazole-3,5-diamines 9e-i, k were prepared and tested for H2-antagonistic activity on the isolated guinea-pig atrium and towards the histamine-stimulated acid secretion of the anaestheti…

Anaesthetized ratIsolamtidinAtrium (architecture)ChemistryStereochemistryDrug DiscoveryPharmaceutical ScienceBiological activityNuclear magnetic resonance spectroscopyArchiv der Pharmazie
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