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    Technical details about Sucrose Octasulfate, learn more about the structure, uses, toxicity, action, side effects and more

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    Sucrose Octasulfate

    APIs // Active Pharmaceutical Ingredients

    PRICE INFORMATION

    MARKET PLACE

    ANALYTICAL SOLUTION(s)

    PharmaCompass

    Phyton is a World Leader in Plant Cell Fermentation Technology and Commercial Manufacturing.

    Athena Pharmaceutiques is a Partner of Choice for Drug Delivery & Life Cycle Management.

    2D Structure
    Also known as: Schembl145070
    Molecular Formula
    C12H22O35S8
    Molecular Weight
    982.8  g/mol
    InChI Key
    WEPNHBQBLCNOBB-FZJVNAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [(2R,3R,4S,5S,6R)-2-[(2R,3R,4R,5S)-3,4-disulfooxy-2,5-bis(sulfooxymethyl)oxolan-2-yl]oxy-3,5-disulfooxy-6-(sulfooxymethyl)oxan-4-yl] hydrogen sulfate
    2.1.2 InChI
    InChI=1S/C12H22O35S8/c13-48(14,15)37-1-4-6(43-51(22,23)24)8(45-53(28,29)30)9(46-54(31,32)33)11(40-4)42-12(3-39-50(19,20)21)10(47-55(34,35)36)7(44-52(25,26)27)5(41-12)2-38-49(16,17)18/h4-11H,1-3H2,(H,13,14,15)(H,16,17,18)(H,19,20,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36)/t4-,5+,6+,7-,8+,9-,10-,11-,12-/m1/s1
    2.1.3 InChI Key
    WEPNHBQBLCNOBB-FZJVNAOYSA-N
    2.1.4 Canonical SMILES
    C(C1C(C(C(C(O1)OC2(C(C(C(O2)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O
    2.1.5 Isomeric SMILES
    C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@@H]([C@@H]([C@@H](O2)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Schembl145070

    2.3 Create Date
    2010-11-09
    3 Chemical and Physical Properties
    Molecular Weight 982.8 g/mol
    Molecular Formula C12H22O35S8
    XLogP3-8.6
    Hydrogen Bond Donor Count8
    Hydrogen Bond Acceptor Count35
    Rotatable Bond Count21
    Exact Mass981.7707318 g/mol
    Monoisotopic Mass981.7707318 g/mol
    Topological Polar Surface Area604 Ų
    Heavy Atom Count55
    Formal Charge0
    Complexity2230
    Isotope Atom Count0
    Defined Atom Stereocenter Count9
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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