Search results for "SHIFT"

showing 10 items of 1226 documents

1H,13C and17O NMR study of aromatic ring-substituted monochloro- and monobromo-(E)-3-phenylpropenals

1991

Trans-Cinnamaldehydes (CAs) or o-, m- and p-X-(E)-3-phenylpropenals; (X = Cl or Br) were synthesized and their 1H, 13C and 17O NMR spectra were measured, assigned and analysed. The long-range benzylic couplings are discussed in terms of the conformational characteristics of the related styrene systems. The 1H, 13C and 17O NMR substituent chemical shifts of the CA derivatives were compared with those of styrene and explained by the π-electron delocalization in the conjugated CCCO bond system of CA.

ChemistryStereochemistryChemical shiftSubstituentGeneral ChemistryNuclear magnetic resonance spectroscopyConjugated systemRing (chemistry)Medicinal chemistryStyrenechemistry.chemical_compoundDelocalized electronGeneral Materials ScienceSolvent effectsMagnetic Resonance in Chemistry
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"Though It Be but Little, It Is Fierce": Excited State Engineering of Conjugated Organic Materials by Fluorination.

2016

Fluorination is frequently used to significantly change the properties of conjugated organic materials due to fluorine’s exceptional properties; well-known is its impact on electronic structure, but it also impacts the geometry despite fluorine’s small size. Less known, the changes in the electronic and geometrical properties may provoke drastic changes of the excited state properties like batho- and hypsochromic shifts of absorption and emission bands (inter alia leading to excited state switching), hypo- and hyperchromic effects, spectral broadening, and changes of the nonradiative deactivation pathways. The state of the art on these issues is summarized in the current Perspective to stim…

Chemistrychemistry.chemical_element02 engineering and technologyElectronic structureConjugated system010402 general chemistry021001 nanoscience & nanotechnology01 natural sciences0104 chemical sciencesChemical physicsExcited stateFluorineOrganic chemistryGeneral Materials ScienceHypsochromic shiftPhysical and Theoretical Chemistry0210 nano-technologyAbsorption (electromagnetic radiation)Doppler broadeningThe journal of physical chemistry letters
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Dyes That Bear Thiazolylazo Groups as Chromogenic Chemosensors for Metal Cations

2011

A family of dyes (L 1-L 6) that contain a thiazolylazo group as signalling subunit and several macrocyclic cavities with different ring sizes and type and number of heteroatoms as binding sites has been synthesized and characterized. Solutions of L 1-L 6 in acetonitrile show broad and structureless absorption bands in the 554-577 nm range with typicalmolar absorption coefficients that range from 20000 to 32000 M -1 cm -1. A detailed protonation study was carried out with solutions of L 1, L 2 and L 5 in acetonitrile. Addition of one equivalent of protons to L 1 and L 2 resulted in the development of a new band at 425 and 370 nm, respectively, which was ascribed to protonation in the aniline…

ChemosensorsHeteroatomQUIMICA INORGANICAProtonationMercuryCation sensorsPhotochemistryInorganic ChemistryMetalchemistry.chemical_compoundAzodyesDensity functional calculationsQUIMICA ORGANICAchemistryLeadAbsorption bandvisual_artBathochromic shiftQUIMICA ANALITICAvisual_art.visual_art_mediumMoietyDensity functional theoryAcetonitrileDyes
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Stress response in mesoangioblast stem cells

2006

Stem cells are presumed to survive various stresses, since they are recruited to areas of tissue damage and regeneration, where inflammatory cytokines and cytotoxic cells may result in severe cell injury. We explored the ability of mesoangioblasts to respond to different cell stresses such as heat, heavy metals and osmotic stress, by analyzing heat shock protein (HSP)70 synthesis as a stress indicator. We found that the A6 mesoangioblast stem cells constitutively synthesize HSP70 in a heat shock transcription factor (HSF)-independent way. However, A6 respond to heat shock and cadmium treatment by synthesizing HSP70 over the constitutive expression and this synthesis is HSF1 dependent. The e…

Chloramphenicol O-AcetyltransferaseHot TemperatureOsmotic shockRecombinant Fusion ProteinsBlotting WesternHypertonic SolutionsElectrophoretic Mobility Shift AssayBiologyResponse ElementsTransfectionMesodermMiceSTRESS RESPONSE STEM CELLS MOUSE MESOANGIOBLASTS.Heat Shock Transcription FactorsHeat shock proteinMetals HeavyAnimalsRNA MessengerHSF1Promoter Regions GeneticMolecular BiologyCells CulturedMesoangioblastHSC70 Heat-Shock ProteinsCell BiologyTransfectionHematopoietic Stem CellsMolecular biologyCell biologyHsp70Heat shock factorDNA-Binding ProteinsGene Expression RegulationStem cellTranscription Factors
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(1Z,3Z)-3-[Quinolin-2(1H)-ylidene]-1-(quinolin-2-yl)prop-1-en-2-ol: An unexpected most stable tautomer of 1,3-bis(quinolin-2-yl)acetone

2009

Abstract 1 H, 13 C and 15 N NMR spectra reveal that CDCl 3 solution of 1,3-bis(quinolin-2-yl)acetone contains only ( 1Z , 3Z )-3-[quinolin-2(1 H )-ylidene]-1-(quinolin-2-yl)prop-1-en-2-ol. The proton transfer takes place between two basic centers of the molecule, which means that the process is an identity reaction by character. The situation is completely different from that detected in chloroform solution of 1,3-bis(pyridin-2-yl)acetone where three different tautomers are in equilibrium with each other. Although the proton transfers in both ( 1Z , 3Z )-3-[quinolin-2(1 H )-ylidene]-1-(quinolin-2-yl)prop-1-en-2-ol and ( 1Z , 3Z )-3-hydroxy-1-[quinolin-2(1 H )-ylidene-4-quinolin-2-yl]but-3-e…

ChloroformStereochemistryChemical shiftOrganic ChemistryConjugated systemTautomerMedicinal chemistryAnalytical ChemistryInorganic ChemistryNMR spectra databasechemistry.chemical_compoundchemistryAb initio quantum chemistry methodsAcetoneMoleculeSpectroscopyJournal of Molecular Structure
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Circular and linear dichroism of aggregates of chlorophyll a and chlorophyll b in 3-methylpentane and paraffin oil.

1996

A circular (CD) and linear dichroism (LD) study of the water adducts of the green plant chlorophylls a (Chl a) and b (Chl b) in hydrocarbon solvents 3-methylpentane and paraffin oil is presented. A strong red shift of the Qy-absorption band from 663 to 746 nm (1678 cm−1) is observed as the water adduct of Chl a is formed. The Chl a-water adduct shows a strong, nonconservative CD signal, which is characterized by a positive peak at 748 nm and two negative peaks at 720 and 771 nm. The maximum CD (AL - AR) is only one order of magnitude smaller than the isotropic absorption maximum. We propose that this exceptionally strong signal is the so-called psi-type CD. The LD spectrum was measured in a…

Chlorophyll bChlorophyll a010304 chemical physicsChemistryAnalytical chemistryfood and beveragesmacromolecular substancesGeneral Medicine010402 general chemistryPhotochemistryLinear dichroism01 natural sciencesBiochemistry0104 chemical sciencesAdductRed shiftchemistry.chemical_compoundAbsorption band0103 physical sciencespolycyclic compoundsPhysical and Theoretical ChemistryAbsorption (chemistry)3-MethylpentanePhotochemistry and Photobiology
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Multimodal Simulation of a Novel Device for a Safe and Effective External Ventricular Drain Placement

2021

BackgroundExternal ventricular drain (EVD) placement is mandatory for several pathologies. The misplacement rate of the EVD varies widely in literature, ranging from 12.3 to 60%. The purpose of this simulation study is to provide preliminary data about the possibility of increasing the safety of one of the most common life-saving procedures in neurosurgery by testing a new device for EVD placement.MethodsWe used a novel guide for positioning the ventricular catheter (patent RM2014A000376). The trajectory was assessed using 25 anonymized head CT scans. The data sets were used to conduct three-dimensional computer-based and combined navigation and augmented reality-based simulations using pla…

Chord (geometry)medicine.medical_specialtyNeuronavigationComputer scienceGeneral NeuroscienceNeurosciences. Biological psychiatry. Neuropsychiatryventriclemedicine.diseasecerebral hypertensionshuntHydrocephalusventricular catheterData setMidline shiftCadavermedicineRadiologyCadaveric spasmhydrocephalusRC321-571NeuroscienceOriginal ResearchExternal ventricular drain
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p53-Mediated downregulation of H ferritin promoter transcriptional efficiency via NF-Y.

2008

The tumor suppressor protein p53 triggers many of the cellular responses to DNA damage by regulating the transcription of a series of downstream target genes. p53 acts on the promoter of the target genes by interacting with the trimeric transcription factor NF-Y. H ferritin promoter activity is tightly dependent on a multiprotein complex called Bbf; on this complex NF-Y plays a major role. The aim of this work was to study the modulation of H ferritin expression levels by p53. CAT reporter assays indicate that: (i) p53 overexpression strongly downregulates the transcriptional efficiency driven by an H ferritin promoter construct containing only the NF-Y recognition sequence and that the phe…

Chromatin ImmunoprecipitationMultiprotein complexTranscription GeneticDown-RegulationBiologyBiochemistryTranscriptional regulationDownregulation and upregulationTranscription (biology)Transcriptional regulationFerritin geneHumansElectrophoretic mobility shift assayp300-CBP Transcription FactorsPromoter Regions GeneticTranscription factorGeneFerritin gene; Transcriptional regulation; Transcriptional factorCell BiologyHCT116 CellsMolecular biologyGene Expression Regulation NeoplasticCCAAT-Binding FactorDoxorubicinTranscriptional factorApoferritinsTumor Suppressor Protein p53Chromatin immunoprecipitationHeLa CellsProtein Binding
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Satb2 Regulates Callosal Projection Neuron Identity in the Developing Cerebral Cortex

2008

SummarySatb2 is a DNA-binding protein that regulates chromatin organization and gene expression. In the developing brain, Satb2 is expressed in cortical neurons that extend axons across the corpus callosum. To assess the role of Satb2 in neurons, we analyzed mice in which the Satb2 locus was disrupted by insertion of a LacZ gene. In mutant mice, β-galactosidase-labeled axons are absent from the corpus callosum and instead descend along the corticospinal tract. Satb2 mutant neurons acquire expression of Ctip2, a transcription factor that is necessary and sufficient for the extension of subcortical projections by cortical neurons. Conversely, ectopic expression of Satb2 in neural stem cells m…

Chromatin ImmunoprecipitationNeuroscience(all)Electrophoretic Mobility Shift AssayMice TransgenicNerve Tissue ProteinsDEVBIOBiologyCorpus callosumMOLNEUROMiceNeural PathwaysmedicineAnimalsCells CulturedCerebral CortexNeuronsRegulation of gene expressionStem CellsGeneral NeuroscienceGene Expression Regulation DevelopmentalMatrix Attachment Region Binding ProteinsDNAEmbryo MammalianNeural stem cellChromatinmedicine.anatomical_structureAnimals NewbornBromodeoxyuridinenervous systemCerebral cortexRegulatory sequenceMutationCorticospinal tractEctopic expressionNeuroscienceTranscription Factors
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Conformational substates of ferricytochrome c revealed by combined optical absorption and electronic circular dichroism spectroscopy at cryogenic tem…

2010

We have investigated the heterogeneity of the Fe(III)–Met80 linkage of horse heart ferricytochrome c by probing the 695 nm charge transfer band with absorption and electronic circular dichroism (ECD) spectroscopy. In order to verify the connection between conformational substates of the Fe(III)–Met80 linkage and the 695 nm band spectral heterogeneity, we have performed experiments as a function of pH (neutral and acidic) and temperature (room and 20 K). At room temperature, the ECD spectrum is blue shifted with respect to the absorption one; the shift is more pronounced at acidic pH and is compatible with the presence of sub-bands. ECD measurements at 20 K highlighted the heterogeneous natu…

Circular dichroismEnergy landscapeAbsorption spectroscopyProtein ConformationBiophysicsAnalytical chemistryMolecular ConformationProtein dynamicsConformational substates; Energy landscape; Charge transfer transitions; Protein dynamicsBiochemistrySpectral lineProtein structureAnimalsHorsesAbsorption (electromagnetic radiation)SpectroscopyChemistryProtein dynamicsCircular DichroismOrganic ChemistryTemperatureCytochromes cHydrogen-Ion ConcentrationConformational substateSettore FIS/07 - Fisica Applicata(Beni Culturali Ambientali Biol.e Medicin)BlueshiftCrystallographyCharge transfer transitionBiophysical chemistry
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