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    Technical details about Cefotetan Acid, learn more about the structure, uses, toxicity, action, side effects and more

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    Cefotetan Acid

    APIs // Active Pharmaceutical Ingredients

    PharmaCompass

    Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

    One Pharma aims to be one of the leading generic companies in Europe.

    2D Structure
    1. Also known as: Dtxsid40860903, Db-055329, Ft-0603035
    Molecular Formula
    C17H17N7O8S4
    Molecular Weight
    575.6  g/mol
    InChI Key
    SRZNHPXWXCNNDU-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    7-[[4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietane-2-carbonyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
    2.1.2 InChI
    InChI=1S/C17H17N7O8S4/c1-23-16(20-21-22-23)34-4-5-3-33-15-17(32-2,14(31)24(15)7(5)11(29)30)19-9(26)13-35-12(36-13)6(8(18)25)10(27)28/h13,15H,3-4H2,1-2H3,(H2,18,25)(H,19,26)(H,27,28)(H,29,30)
    2.1.3 InChI Key
    SRZNHPXWXCNNDU-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)(NC(=O)C4SC(=C(C(=O)N)C(=O)O)S4)OC)SC2)C(=O)O
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Dtxsid40860903

    2. Db-055329

    3. Ft-0603035

    2.3 Create Date
    2005-09-16
    3 Chemical and Physical Properties
    Molecular Weight 575.6 g/mol
    Molecular Formula C17H17N7O8S4
    XLogP30.1
    Hydrogen Bond Donor Count4
    Hydrogen Bond Acceptor Count15
    Rotatable Bond Count9
    Exact Mass575.00214522 g/mol
    Monoisotopic Mass575.00214522 g/mol
    Topological Polar Surface Area321 Ų
    Heavy Atom Count36
    Formal Charge0
    Complexity1090
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count2
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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