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    Technical details about Oxitropium Bromide, learn more about the structure, uses, toxicity, action, side effects and more

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    Oxitropium Bromide

    APIs // Active Pharmaceutical Ingredients

    DOSSIERs // Finished Dosage Forms

    GLOBAL SALES INFORMATION

    PharmaCompass

    Centrient is a leading manufacturer of Beta-Lactam Antibiotics and a provider of next-generation Statins and Antifungals.

    IKF/Pharmasynthese have been with fine chemicals market and APIs performance for more than 40 years.

    2D Structure
    1. Also known as: Oxitropium bromide, 30286-75-0, (9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenylpropanoate;bromide, [(1s,2s,4r,5s)-9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl] (2s)-3-hydroxy-2-phenylpropanoate;bromide, Schembl109688
    Molecular Formula
    C19H26BrNO4
    Molecular Weight
    412.3  g/mol
    InChI Key
    LCELQERNWLBPSY-UHFFFAOYSA-M
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenylpropanoate;bromide
    2.1.2 InChI
    InChI=1S/C19H26NO4.BrH/c1-3-20(2)15-9-13(10-16(20)18-17(15)24-18)23-19(22)14(11-21)12-7-5-4-6-8-12;/h4-8,13-18,21H,3,9-11H2,1-2H3;1H/q+1;/p-1
    2.1.3 InChI Key
    LCELQERNWLBPSY-UHFFFAOYSA-M
    2.1.4 Canonical SMILES
    CC[N+]1(C2CC(CC1C3C2O3)OC(=O)C(CO)C4=CC=CC=C4)C.[Br-]
    2.2 Synonyms
    2.2.1 MeSH Synonyms

    1. (8r)-6 Beta,7 Beta-epoxy-8-ethyl-3 Alpha((-)-tropoyl)-1 Alpha H, 5 Alpha H-tropanium Bromide

    2. Ba 253

    3. Ba 253br

    4. Ba-253

    5. Ba-253br

    6. Oxitropium

    7. Oxitropium Bromide

    8. Oxitropium Iodide, (r)-isomer

    9. Oxitropium Iodide, (s)-isomer

    10. Oxivent

    11. Oxytropium Bromide

    12. Tersigat

    13. Ventilat

    2.2.2 Depositor-Supplied Synonyms

    1. Oxitropium Bromide

    2. 30286-75-0

    3. (9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenylpropanoate;bromide

    4. [(1s,2s,4r,5s)-9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl] (2s)-3-hydroxy-2-phenylpropanoate;bromide

    5. Schembl109688

    2.3 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 412.3 g/mol
    Molecular Formula C19H26BrNO4
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count6
    Exact Mass411.10452 g/mol
    Monoisotopic Mass411.10452 g/mol
    Topological Polar Surface Area59.1 Ų
    Heavy Atom Count25
    Formal Charge0
    Complexity472
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count5
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Parasympatholytics

    Agents that inhibit the actions of the parasympathetic nervous system. The major group of drugs used therapeutically for this purpose is the MUSCARINIC ANTAGONISTS. (See all compounds classified as Parasympatholytics.)

    4.2 ATC Code

    R - Respiratory system

    R03 - Drugs for obstructive airway diseases

    R03B - Other drugs for obstructive airway diseases, inhalants

    R03BB - Anticholinergics

    R03BB02 - Oxitropium bromide

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