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    Technical details about Prestwick3_000771, learn more about the structure, uses, toxicity, action, side effects and more

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    Prestwick3_000771

    APIs // Active Pharmaceutical Ingredients

    PRICE INFORMATION

    DOSSIERs // Finished Dosage Forms

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    2D Structure
    Also known as: Mls002153993, Prestwick0_000771, Prestwick1_000771, Prestwick2_000771, Prestwick3_000771, Bspbio_000842
    Molecular Formula
    C28H37ClO7
    Molecular Weight
    521.0  g/mol
    InChI Key
    DJHCCTTVDRAMEH-LSTGEUPGSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [2-[(7R,8S,9S,10R,11S,13S,14S,16R)-7-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate
    2.1.2 InChI
    InChI=1S/C28H37ClO7/c1-6-22(33)35-14-21(32)28(36-23(34)7-2)15(3)10-18-24-19(29)12-16-11-17(30)8-9-26(16,4)25(24)20(31)13-27(18,28)5/h8-9,11,15,18-20,24-25,31H,6-7,10,12-14H2,1-5H3/t15-,18+,19-,20+,24-,25+,26+,27+,28?/m1/s1
    2.1.3 InChI Key
    DJHCCTTVDRAMEH-LSTGEUPGSA-N
    2.1.4 Canonical SMILES
    CCC(=O)OCC(=O)C1(C(CC2C1(CC(C3C2C(CC4=CC(=O)C=CC34C)Cl)O)C)C)OC(=O)CC
    2.1.5 Isomeric SMILES
    CCC(=O)OCC(=O)C1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2[C@@H](CC4=CC(=O)C=C[C@]34C)Cl)O)C)C)OC(=O)CC
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Mls002153993

    2. Prestwick0_000771

    3. Prestwick1_000771

    4. Prestwick2_000771

    5. Prestwick3_000771

    6. Bspbio_000842

    7. Spbio_002781

    8. Bpbio1_000928

    9. Chembl1377952

    10. Schembl13985345

    11. Hms1570k04

    12. Hms2097k04

    13. Hms2230e23

    14. Hms3714k04

    15. Ccg-220771

    16. Ncgc00179403-01

    17. Smr001233327

    18. Ab00513918

    19. Brd-a74610643-001-03-1

    2.3 Create Date
    2006-06-05
    3 Chemical and Physical Properties
    Molecular Weight 521.0 g/mol
    Molecular Formula C28H37ClO7
    XLogP33.2
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count8
    Exact Mass520.2227812 g/mol
    Monoisotopic Mass520.2227812 g/mol
    Topological Polar Surface Area107 Ų
    Heavy Atom Count36
    Formal Charge0
    Complexity1030
    Isotope Atom Count0
    Defined Atom Stereocenter Count8
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Drug and Medication Information
    4.1 Drug Information
    1 of 2  
    Drug NameAlclometasone dipropionate
    Drug LabelAlclometasone dipropionate ointment contains alclometasone dipropionate (7-chloro-11 ,17,21-trihydroxy-16 -methylpregna-1,4-diene-3,20-dione 17,21-dipropionate), a synthetic corticosteroid for topical dermatologic use. The corticosteroids const...
    Active IngredientAlclometasone dipropionate
    Dosage FormOintment; Cream
    RouteTopical
    Strength0.05%
    Market StatusPrescription
    CompanyGlenmark Generics; Fougera Pharms; Taro

    2 of 2  
    Drug NameAlclometasone dipropionate
    Drug LabelAlclometasone dipropionate ointment contains alclometasone dipropionate (7-chloro-11 ,17,21-trihydroxy-16 -methylpregna-1,4-diene-3,20-dione 17,21-dipropionate), a synthetic corticosteroid for topical dermatologic use. The corticosteroids const...
    Active IngredientAlclometasone dipropionate
    Dosage FormOintment; Cream
    RouteTopical
    Strength0.05%
    Market StatusPrescription
    CompanyGlenmark Generics; Fougera Pharms; Taro

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