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53164-05-9,MFCD00151473
Catalog No.:AA00ILLP

53164-05-9 | 2-[2-[1-(4-chloro-2,3,5,6-tetradeuteriobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxyacetic acid

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100mg
98%
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$6.00   $4.00
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1g
>98.0%(GC)(T)
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$26.00   $18.00
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5g
>98.0%(GC)(T)
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$76.00   $53.00
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25g
>98.0%(GC)(T)
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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00ILLP
Chemical Name:
2-[2-[1-(4-chloro-2,3,5,6-tetradeuteriobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxyacetic acid
CAS Number:
53164-05-9
Molecular Formula:
C21H18ClNO6
Molecular Weight:
415.8237
MDL Number:
MFCD00151473
SMILES:
COc1ccc2c(c1)c(CC(=O)OCC(=O)O)c(n2C(=O)c1ccc(cc1)Cl)C
NSC Number:
757413
Properties
Computed Properties
 
Complexity:
620  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
7  
XLogP3:
4.2  

Literature

Title: Late drug eluting stent thrombosis due to acemetacine: type III Kounis syndrome: Kounis syndrome due to acemetacine.

Journal: International journal of cardiology 20120322

Title: Aspirin, steroidal and non-steroidal anti-inflammatory drugs for the treatment of Alzheimer's disease.

Journal: The Cochrane database of systematic reviews 20120215

Title: Using functional signatures to identify repositioned drugs for breast, myelogenous leukemia and prostate cancer.

Journal: PLoS computational biology 20120201

Title: Risk of hospitalization for upper gastrointestinal adverse events associated with nonsteroidal anti-inflammatory drugs: a nationwide case-crossover study in Taiwan.

Journal: Pharmacoepidemiology and drug safety 20110701

Title: Identification of curcumin derivatives as human glyoxalase I inhibitors: A combination of biological evaluation, molecular docking, 3D-QSAR and molecular dynamics simulation studies.

Journal: Bioorganic & medicinal chemistry 20110201

Title: Single dose oral analgesics for acute postoperative pain in adults.

Journal: The Cochrane database of systematic reviews 20110101

Title: Development of a list of potentially inappropriate drugs for the korean elderly using the delphi method.

Journal: Healthcare informatics research 20101201

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: High-throughput microplate assay for the determination of drug partition coefficients.

Journal: Nature protocols 20101101

Title: Effect of ketorolac and diclofenac on the impairment of endothelium-dependent relaxation induced by reactive oxygen species in rabbit abdominal aorta.

Journal: Korean journal of anesthesiology 20100901

Title: Acemetacin antinociceptive mechanism is not related to NO or K+ channel pathways.

Journal: Methods and findings in experimental and clinical pharmacology 20100301

Title: Evaluation of the short-term efficacy of NSAIDs on patients with active ankylosing spondylitis in daily practice: a 3-month, longitudinal, observational study.

Journal: Rheumatology international 20100101

Title: Development and evaluation of pharmacosomes of aceclofenac.

Journal: Indian journal of pharmaceutical sciences 20100101

Title: Risk of Upper Gastrointestinal Bleeding in a Cohort of New Users of Low-Dose ASA for Secondary Prevention of Cardiovascular Outcomes.

Journal: Frontiers in pharmacology 20100101

Title: [Randomized, double blind, multicentre, parallel group study to compare efficacy and safety of acemetacin and indometacin in patients with activated osteoarthrosis of the knee].

Journal: Praxis 20090610

Title: A comparison of low-molecular-weight heparin and combined therapy of low-molecular-weight heparin with an anti-inflammatory agent in the treatment of superficial vein thrombosis.

Journal: Phlebology 20090401

Title: Bartter's syndrome with type 2 diabetes mellitus.

Journal: Journal of the Chinese Medical Association : JCMA 20090201

Title: Pharmacokinetics of acemetacin and its active metabolite indomethacin in rats during acute hepatic damage and liver regeneration.

Journal: Annals of hepatology 20090101

Title: Single dose oral acemetacin for acute postoperative pain in adults.

Journal: The Cochrane database of systematic reviews 20090101

Title: Lack of effects of acemetacin on signalling pathways for leukocyte adherence may explain its gastrointestinal safety.

Journal: British journal of pharmacology 20081101

Title: Binding of nonsteroidal anti-inflammatory drugs to DPPC: structure and thermodynamic aspects.

Journal: Langmuir : the ACS journal of surfaces and colloids 20080415

Title: Patients with rheumatoid arthritis have an altered circulatory aggrecan profile.

Journal: BMC musculoskeletal disorders 20080101

Title: Accuracy of drug advertisements in medical journals under new law regulating the marketing of pharmaceutical products in Switzerland.

Journal: BMC medical informatics and decision making 20080101

Title: Evaluation of the interaction between acemetacin and opioids on the hargreaves model of thermal hyperalgesia.

Journal: Pharmacology, biochemistry, and behavior 20071101

Title: Mechanisms underlying the anti-inflammatory activity and gastric safety of acemetacin.

Journal: British journal of pharmacology 20071101

Title: Development and validation of a highly sensitive ELISA for the determination of pharmaceutical indomethacin in water samples.

Journal: Talanta 20070915

Title: Acemetacin monohydrate.

Journal: Acta crystallographica. Section C, Crystal structure communications 20070801

Title: Traditional nonsteroidal anti-inflammatory drugs and postmenopausal hormone therapy: a drug-drug interaction?

Journal: PLoS medicine 20070501

Title: Lack of influence of body mass index on efficacy and tolerance of acemetacin in short-term treatment of musculoskeletal diseases.

Journal: Rheumatology international 20070201

Title: Polyproline-rod approach to isolating protein targets of bioactive small molecules: isolation of a new target of indomethacin.

Journal: Journal of the American Chemical Society 20070131

Title: Prescribing of COX-2 inhibitors in Germany after safety warnings and market withdrawals.

Journal: Die Pharmazie 20061001

Title: An exploratory theoretical elucidation on the peroxyl-radical-scavenging mechanism and structure-activity relationship of nonsteroidal anti-inflammatory drugs.

Journal: Bioorganic & medicinal chemistry letters 20060615

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: Hydrogen peroxide scavenging activity by non-steroidal anti-inflammatory drugs.

Journal: Life sciences 20050429

Title: ABC transporters as multidrug resistance mechanisms and the development of chemosensitizers for their reversal.

Journal: Cancer cell international 20050101

Title: Long-term use of non-steroidal anti-inflammatory drugs and the risk of myocardial infarction in the general population.

Journal: BMC medicine 20050101

Title: In vitro scavenging activity for reactive oxygen and nitrogen species by nonsteroidal anti-inflammatory indole, pyrrole, and oxazole derivative drugs.

Journal: Free radical biology & medicine 20041201

Title: [Flow injection chemiluminescent detection of acemetacin in KMnO4 - Na2 SO3 system].

Journal: Yao xue xue bao = Acta pharmaceutica Sinica 20041101

Title: Comparison between sodium dodecylsulphate and cetyltrimethylammonium bromide as mobile phases in the micellar liquid chromatography determination of non-steroidal anti-inflammatory drugs in pharmaceuticals.

Journal: Journal of pharmaceutical and biomedical analysis 20041029

Title: Novel cyclooxygenase-1 inhibitors discovered using affinity fingerprints.

Journal: Journal of medicinal chemistry 20040923

Title: [Treatment of osteoarthritis of the knee joint. Efficacy and tolerance to acemetacin slow release in comparison to celecoxib].

Journal: Der Orthopade 20040901

Title: Risk of breast cancer among users of aspirin and other anti-inflammatory drugs.

Journal: British journal of cancer 20040802

Title: Simultaneous determination of several antalgic drugs based on their interactions with beta-cyclodextrin by capillary zone electrophoresis.

Journal: Journal of chromatographic science 20040301

Title: Interaction of antiinflammatory drugs with EPC liposomes: calorimetric study in a broad concentration range.

Journal: Biophysical journal 20040201

Title: Treatment of congenital nephrogenic diabetes insipidus with hydrochlorothiazide and amiloride in an adult patient.

Journal: Hormone research 20040101

Title: [The hydroxam reaction of indometacin and acemetacin].

Journal: Die Pharmazie 20030601

Title: The self-association of the drug acemetacin and its interactions and stabilization with beta-cyclodextrin in aqueous solution as inferred from NMR spectroscopy and HPLC studies.

Journal: Carbohydrate research 20020903

Title: Corticosteroid injection vs. nonsteroidal antiinflammatory drug and splinting in carpal tunnel syndrome.

Journal: American journal of physical medicine & rehabilitation 20020301

Title: Cutting edge: agonistic effect of indomethacin on a prostaglandin D2 receptor, CRTH2.

Journal: Journal of immunology (Baltimore, Md. : 1950) 20020201

Title: A double-blind, randomized, controlled parallel group study evaluating the efficacy and safety of acemetacin for the management of osteoarthritis.

Journal: International journal of clinical pharmacology research 20020101

Title: Efficacy and tolerability of acemetacin, a non-steroidal anti-inflammatory drug, in Mexican patients: result of the ETAPAM Study.

Journal: Proceedings of the Western Pharmacology Society 20020101

Title: Comparison of the efficacy of local corticosteroid injection and physical therapy for the treatment of adhesive capsulitis.

Journal: Rheumatology international 20010901

Title: In vitro effects of NSAIDS and paracetamol on oxidative stress-related parameters of human erythrocytes.

Journal: Experimental and toxicologic pathology : official journal of the Gesellschaft fur Toxikologische Pathologie 20010601

Title: Effect of liposomes on the rate of alkaline hydrolysis of indomethacin and acemetacin.

Journal: Journal of pharmaceutical sciences 20010301

Title: A fast and reliable spectroscopic method for the determination of membrane--water partition coefficients of organic compounds.

Journal: Lipids 20010101

Title: Risk of upper gastrointestinal bleeding and perforation associated with low-dose aspirin as plain and enteric-coated formulations.

Journal: BMC clinical pharmacology 20010101

Title: Screening procedure for detection of non-steroidal anti-inflammatory drugs and their metabolites in urine as part of a systematic toxicological analysis procedure for acidic drugs and poisons by gas chromatography-mass spectrometry after extractive methylation.

Journal: Journal of analytical toxicology 20010101

Title: Tavares IA, et al. Non-steroidal anti-inflammatory drugs that cause relatively little gastric damage. J Gastroenterol Hepatol. 1998 Nov;13(S3):S190-S192.

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Tags:53164-05-9 Molecular Formula|53164-05-9 MDL|53164-05-9 SMILES|53164-05-9 2-[2-[1-(4-chloro-2,3,5,6-tetradeuteriobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxyacetic acid |Heterocyclic_Building_Blocks