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    Technical details about Tin Mesoporphyrin, learn more about the structure, uses, toxicity, action, side effects and more

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    Tin Mesoporphyrin

    APIs // Active Pharmaceutical Ingredients

    DIGITAL CONTENT

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    2D Structure
    1. Also known as: Snmp, Stannsoporfin (usan/inn), D05922, J-001579, 3-[18-(2-carboxylatoethyl)-8,13-diethyl-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate;hydron;tin(4+);dichloride
    Molecular Formula
    C34H36Cl2N4O4Sn
    Molecular Weight
    754.3  g/mol
    InChI Key
    LLDZJTIZVZFNCM-UHFFFAOYSA-J
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-[18-(2-carboxylatoethyl)-8,13-diethyl-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate;hydron;tin(4+);dichloride
    2.1.2 InChI
    InChI=1S/C34H38N4O4.2ClH.Sn/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;;;/h13-16H,7-12H2,1-6H3,(H4,35,36,37,38,39,40,41,42);2*1H;/q;;;+4/p-4
    2.1.3 InChI Key
    LLDZJTIZVZFNCM-UHFFFAOYSA-J
    2.1.4 Canonical SMILES
    [H+].[H+].CCC1=C(C2=NC1=CC3=C(C(=C([N-]3)C=C4C(=C(C(=CC5=NC(=C2)C(=C5C)CC)[N-]4)C)CCC(=O)[O-])CCC(=O)[O-])C)C.[Cl-].[Cl-].[Sn+4]
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Snmp

    2. Stannsoporfin (usan/inn)

    3. D05922

    4. J-001579

    5. 3-[18-(2-carboxylatoethyl)-8,13-diethyl-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoate;hydron;tin(4+);dichloride

    2.3 Create Date
    2008-02-08
    3 Chemical and Physical Properties
    Molecular Weight 754.3 g/mol
    Molecular Formula C34H36Cl2N4O4Sn
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count10
    Rotatable Bond Count6
    Exact Mass754.113564 g/mol
    Monoisotopic Mass754.113564 g/mol
    Topological Polar Surface Area108 Ų
    Heavy Atom Count45
    Formal Charge0
    Complexity938
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count6
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