Search results for "Alkyne"

showing 10 items of 141 documents

Direct subphthalocyanine conjugation to bombesin vs. indirect conjugation to its lipidic nanocarrier

2016

International audience; Bombesin (BBN) was covalently bound to graftable subphthalocyanine (SubPc) or to a cholesterol derivative, a component of a liposome that encapsulates non-graftable SubPc. The latter bioconjugation approach was suitable to address the stability of SubPc and was achieved by copper-free click-chemistry on the outer-face of the liposome. Liposomes were purified (FPLC) and then analyzed in size (outer diameter about 60 nm measured by DLS). In vitro binding studies allowed to determine the IC50 13.9 nM for one component of the liposome, cholesterol, conjugated to BBN. Hence, azido- (or alkynyl-) liposomes give fluorophores with no reactive functional group available on th…

AzidesIndolesStereochemistryefficacyConjugated systemIsoindoles010402 general chemistry01 natural sciencesBiochemistry[ CHIM ] Chemical Scienceschemistry.chemical_compound[ CHIM.ORGA ] Chemical Sciences/Organic chemistry[CHIM]Chemical SciencesPhysical and Theoretical Chemistrysilicon phthalocyaninesmelanoma-cellsLiposomeBioconjugationfluorescent[CHIM.ORGA]Chemical Sciences/Organic chemistry010405 organic chemistryOrganic ChemistryBombesinFast protein liquid chromatographyCombinatorial chemistryFluorescence0104 chemical sciencesNanostructuresmelanocyteschemistryphotodynamic therapyCovalent bondAlkynesLiposomesBombesinactivationNanocarriers
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Generic Method for Modular Surface Modification of Cellulosic Materials in Aqueous Medium by Sequential Click-Reaction and Adsorption

2012

A generic approach for heterogeneous surface modification of cellulosic materials in aqueous medium, applicable for a wide range of functionalizations, is presented. In the first step, carboxymethyl cellulose (CMC) modified with azide or alkyne functionality, was adsorbed on a cellulosic substrate, thus, providing reactive sites for azide–alkyne cycloaddition click reactions. In the second step, functional units with complementary click units were reacted on the cellulose surface, coated by the click-modified CMC. Selected model functionalizations on diverse cellulosic substrates are shown to demonstrate the generality of the approach. The concept by sequentially combining the robust physic…

AzidesMagnetic Resonance SpectroscopyPolymers and PlasticsSurface Propertiesta221BioengineeringMicroscopy Atomic ForceCatalysisNanocellulosePolyethylene GlycolsmaterialsBiomaterialschemistry.chemical_compoundAdsorptionSpectroscopy Fourier Transform Infraredotorhinolaryngologic diseasesMaterials ChemistrymedicineOrganic chemistryAnimalsCotton FiberCelluloseta216ta116ta215ta218nanocelluloseFluorescent Dyesta214ta114Photoelectron Spectroscopyclick-reactionsSubstrate (chemistry)WaterSerum Albumin BovineCombinatorial chemistrycelluloseCarboxymethyl cellulosefunctionalchemistryadsorptionAlkynesCarboxymethylcellulose SodiumSurface functionalizationClick chemistrySurface modificationCattleAzidemedicine.drugBIOMACROMOLECULES
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Amphiphilic Polysaccharide Block Copolymers for pH-Responsive Micellar Nanoparticles

2017

A full polysaccharide amphiphilic block copolymer was prepared from end group-functionalized dextrans using copper-mediated azide-alkyne click chemistry. Sufficient modification of the reducing end in both blocks was achieved by microwave-enhanced reductive amination in a borate-buffer/methanol solvent system. The combination of a hydrophilic dextran block with a hydrophobic acetalated dextran block results in an amphiphilic structure that turns water-soluble upon acid treatment. The material has a low critical micelle concentration and self-assembles in water to spherical micellar nanoparticles. The formed nanoparticles have a narrow size distribution below 70 nm in diameter and disassembl…

AzidesPolymers and PlasticsNanoparticleBioengineering02 engineering and technology010402 general chemistry01 natural sciencesReductive aminationBiomaterialsSurface-Active Agentschemistry.chemical_compoundAmphiphileMaterials ChemistryCopolymerOrganic chemistryMicrowavesMicellesAqueous solutionChemistryDextransHydrogen-Ion Concentration021001 nanoscience & nanotechnology0104 chemical sciencesDextranChemical engineeringAlkynesCritical micelle concentrationClick chemistryNanoparticlesClick Chemistry0210 nano-technologyHydrophobic and Hydrophilic InteractionsCopperBiomacromolecules
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A Theoretical Study of the Relationship between the Electrophilicity ω Index and Hammett Constant σp in [3+2] Cycloaddition Reactions of Aryl Azide/A…

2016

The relationship between the electrophilicity ω index and the Hammett constant σp has been studied for the [2+3] cycloaddition reactions of a series of para-substituted phenyl azides towards para-substituted phenyl alkynes. The electrophilicity ω index—a reactivity density functional theory (DFT) descriptor evaluated at the ground state of the molecules—shows a good linear relationship with the Hammett substituent constants σp. The theoretical scale of reactivity correctly explains the electrophilic activation/deactivation effects promoted by electron-withdrawing and electron-releasing substituents in both azide and alkyne components.

AzidesSubstituentPharmaceutical ScienceAlkynearylazides010402 general chemistryPhotochemistry01 natural sciencesArticleAnalytical Chemistrylcsh:QD241-441electrophilicity indexchemistry.chemical_compound[2+3] cycloaddition reactionslcsh:Organic chemistryComputational chemistryDrug DiscoveryReactivity (chemistry)Physical and Theoretical Chemistrychemistry.chemical_classificationsubstituent effects010405 organic chemistryArylOrganic Chemistry[2+3] cycloaddition reactions; arylazides; arylalkynes; substituent effects; electrophilicity index; Hammett constantsCycloaddition0104 chemical sciencesModels ChemicalchemistryChemistry (miscellaneous)AlkynesElectrophilearylalkynesHammett constantsMolecular MedicineDensity functional theoryAzideMolecules; Volume 21; Issue 11; Pages: 1434
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Kinetics of the Strain-Promoted Oxidation-Controlled Cycloalkyne-1,2-quinone Cycloaddition: Experimental and Theoretical Studies

2018

Stimulated by its success in both bioconjugation and surface modification, we studied the strain-promoted oxidation-controlled cycloalkyne–1,2-quinone cycloaddition (SPOCQ) in three ways. First, the second-order rate constants and activation parameters (ΔH⧧) were determined of various cyclooctynes reacting with 4-tert-butyl-1,2-quinone in a SPOCQ reaction, yielding values for ΔH⧧ of 4.5, 7.3, and 12.1 kcal/mol, for bicyclo[6.1.0]non-4-yne (BCN), cyclooctyne (OCT), and dibenzoazacyclooctyne (DIBAC), respectively. Second, their reaction paths were investigated in detail by a range of quantum mechanical calculations. Single-configuration theoretical methods, like various DFT and a range of MP2…

Bicyclic molecule010405 organic chemistryChemistryOrganic ChemistryKineticsSolvationCycloalkyne010402 general chemistryOrganische Chemie01 natural sciencesArticleCycloaddition0104 chemical sciencesQuinonechemistry.chemical_compoundReaction rate constantComputational chemistryLife ScienceSurface modificationQuímica orgànicaVLAGThe Journal of Organic Chemistry
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Inhibition of liver trans-sulphuration pathway by propargylglycine mimics gene expression changes found in the mammary gland of weaned lactating rats…

2003

In the lactatingmammary gland, weaning produces mitochondrial cytochrome c release and nuclear DNA fragmentation, as determined by gel electrophoresis. This is followed by a significant decrease in lactation. Weaning for 2 h produces an early induction of the tumour suppressor/transcription factor p53, whereas the oncoprotein c-Jun and c-Jun N-terminal kinase are elevated after 24 h of weaning when compared with controls. The expression of p21cip1 and p27kip1, cyclin-dependent kinase inhibitors, was significantly higher in weaned rats when compared with control lactating rats. All the changes mentioned above also happen in the lactatingmammary gland when propargylglycine, an inhibitor of th…

BiochemistryAcetylcysteinechemistry.chemical_compoundLactationGene expressionGamma-glutamyltransferaseRegulation of gene expression:CIENCIAS DE LA VIDA::Bioquímica [UNESCO]biologyReverse Transcriptase Polymerase Chain ReactionCystathionine gamma-lyaseapoptosisgamma-Glutamyltransferaseglutathione (GSH)Glutathioneγ-cystathionasemedicine.anatomical_structureLiverAlkynesFemaleResearch Articlemedicine.drugmedicine.medical_specialtyGlycinel-cysteinelactationWeaningMammary Glands AnimalInternal medicinemedicineAnimalsLactationButhionine sulfoximineRats WistarButhionine SulfoximineMolecular BiologyDNA PrimersBase SequenceCystathionine gamma-LyaseUNESCO::CIENCIAS DE LA VIDA::BioquímicaCell BiologyGlutathioneAcetylcysteineRatsEndocrinologyGene Expression Regulationchemistrybiology.proteinSulfurBiochemical Journal
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DMAP-BODIPY Alkynes: A Convenient Tool for Labeling Biomolecules for Bimodal PET-Optical Imaging

2014

Several new boron dipyrromethene/N,N-dimethylaminopyridine (BODIPY-DMAP) assemblies were synthesized as precursors for bimodal imaging probes (optical imaging, OI/positron emission tomography, PET). The photophysical properties of the new compounds were also studied. The first proof-of-concept was obtained with the preparation of several new BODIPY-labeled bombesins and evaluation of the affinity for bombesin receptors by using a competition binding assay. Fluorination reactions were investigated on DMAP-BODIPY precursors as well as on DMAP-BODIPY-labeled bombesins. Chemical modifications on the BODIPY core were also performed to obtain luminescent dyes emitting in the therapeutic window (6…

Boron CompoundsHalogenationPyridineschemistry.chemical_elementCatalysischemistry.chemical_compoundmedicineOrganic chemistrychemistry.chemical_classificationLuminescent Agentsmedicine.diagnostic_testLigand binding assayBiomoleculeOptical ImagingOrganic ChemistryGeneral ChemistryCombinatorial chemistrychemistryPositron emission tomographyAlkynesPositron-Emission TomographyClick chemistryFluorineBombesinClick ChemistryBODIPYLuminescencePreclinical imagingChemistry - A European Journal
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Pauson-Khand reaction of internal dissymmetric trifluoromethyl alkynes. Influence of the alkene on the regioselectivity.

2014

Abstract: The scope of the Pauson-Khand reaction (PKR) of internal trifluoromethyl alkynes, previously described with norbornadiene, is expanded to norbornene and ethylene. A thorough structural analysis of the resulting PK adducts has been carried out to unveil that α-trifluoromethylcyclopentenones are preferred in all cases, independently of the electronic properties of the alkyne. The regioselectivity observed with norbornadiene and ethylene is higher than in the case of norbornene.

Ciclització (Química)EthyleneHydrocarbons FluorinatedStereochemistryNorbornadieneQuímica organometàl·licaPharmaceutical ScienceAlkynetrifluoromethylalkynesCrystallography X-RayArticlecyclopentenonesAnalytical ChemistryRing formation (Chemistry)cycloadditionslcsh:QD241-441chemistry.chemical_compoundlcsh:Organic chemistryDrug DiscoveryPhysical and Theoretical ChemistryNorbornenechemistry.chemical_classificationPauson-Khand reactionTrifluoromethylMolecular StructureAlkenePauson–Khand reactionOrganic ChemistryRegioselectivityStereoisomerismCobaltEthylenesNorbornaneschemistryOrganometallic chemistryChemistry (miscellaneous)AlkynesregioselectivityMolecular MedicineMolecules (Basel, Switzerland)
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Efavirenz: What is known about the cellular mechanisms responsible for its adverse effects

2017

The HIV infection remains an important health problem worldwide. However, due to the efficacy of combined antiretroviral therapy (cART), it has ceased to be a mortal condition, becoming a chronic disease instead. Efavirenz, the most prescribed non-nucleoside analogue reverse transcriptase inhibitor (NNRTI), has been a key component of cART since its commercialization in 1998. Though still a drug of choice in many countries, its primacy has been challenged by the arrival of newer antiretroviral agents with better toxicity profiles and treatment adherence. The major side effects related to EFV have been widely described in clinical studies, however the mechanisms that participate in their pat…

Cyclopropanes0301 basic medicineDrugCartEfavirenzAnti-HIV Agentsmedia_common.quotation_subjectHIV InfectionsPharmacologymedicine.disease_cause03 medical and health scienceschemistry.chemical_compoundIn vivomedicineAnimalsHumansAdverse effectmedia_commonPharmacologyReverse-transcriptase inhibitorbusiness.industryAutophagyBenzoxazines030104 developmental biologychemistryAlkynesbusinessOxidative stressmedicine.drugEuropean Journal of Pharmacology
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Neuronal Bioenergetics and Acute Mitochondrial Dysfunction: A Clue to Understanding the Central Nervous System Side Effects of Efavirenz

2014

Background. Neurological pathogenesis is associated with mitochondrial dysfunction and differences in neuronal/glial handling of oxygen and glucose. The main side effects attributed to efavirenz involve the CNS, but the underlying mechanisms are unclear. Methods. Human cell lines and rat primary cultures of neurons and astrocytes were treated with clinically relevant efavirenz concentration. Results. Efavirenz alters mitochondrial respiration, enhances reactive oxygen species generation, undermines mitochondrial membrane potential, and reduces adenosine triphosphate (ATP) levels in a concentration-dependent fashion in both neurons and glial cells. However, it activates adenosine monophospha…

CyclopropanesCell SurvivalCell RespirationPharmacologyMitochondrionBiologymedicine.disease_causechemistry.chemical_compoundOxygen ConsumptionHIV-associated neurocognitive disordersSuperoxidesnitric oxideCell Line TumorneurotoxicitymedicineAnimalsHumansImmunology and AllergyGlycolysisRats WistarMembrane Potential MitochondrialNeuronsMembrane potentialDose-Response Relationship DrugNeurotoxicityHIVefavirenzmedicine.diseasecentral nervous systemAdenosineBenzoxazinesMitochondriaRatsmitochondriaInfectious Diseasesmedicine.anatomical_structurechemistrynervous systemAlkynesAstrocytesReverse Transcriptase InhibitorsNeurogliaEnergy MetabolismNeurogliaAdenosine triphosphateOxidative stressmedicine.drug
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