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    Technical details about Prestwick3_001033, learn more about the structure, uses, toxicity, action, side effects and more

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    Prestwick3_001033

    APIs // Active Pharmaceutical Ingredients

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    DOSSIERs // Finished Dosage Forms

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    DIGITAL CONTENT

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

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    2D Structure
    Also known as: 58652-20-3, Nomegestrol 17-acetate, Tx 066, Tx-066, 19-norpregna-4,6-diene-3,20-dione, 17-(acetyloxy)-6-methyl-, Nomegestrol acetate [usan]
    Molecular Formula
    C23H30O4
    Molecular Weight
    370.5  g/mol
    InChI Key
    IIVBFTNIGYRNQY-YQLZSBIMSA-N
    FDA UNII
    83J78V5W05
    Nomegestrol acetate, also known as NOMAC, is a progestin used in oral contraceptives, menopausal hormone therapy, and for the treatment of gynecological disorders.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [(8S,9S,10R,13S,14S,17R)-17-acetyl-6,13-dimethyl-3-oxo-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate
    2.1.2 InChI
    InChI=1S/C23H30O4/c1-13-11-20-18(17-6-5-16(26)12-19(13)17)7-9-22(4)21(20)8-10-23(22,14(2)24)27-15(3)25/h11-12,17-18,20-21H,5-10H2,1-4H3/t17-,18-,20-,21+,22+,23+/m1/s1
    2.1.3 InChI Key
    IIVBFTNIGYRNQY-YQLZSBIMSA-N
    2.1.4 Canonical SMILES
    CC1=CC2C(CCC3(C2CCC3(C(=O)C)OC(=O)C)C)C4C1=CC(=O)CC4
    2.1.5 Isomeric SMILES
    CC1=C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)OC(=O)C)C)[C@@H]4C1=CC(=O)CC4
    2.2 Other Identifiers
    2.2.1 UNII
    83J78V5W05
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Tx 066

    2. Tx-066

    2.3.2 Depositor-Supplied Synonyms

    1. 58652-20-3

    2. Nomegestrol 17-acetate

    3. Tx 066

    4. Tx-066

    5. 19-norpregna-4,6-diene-3,20-dione, 17-(acetyloxy)-6-methyl-

    6. Nomegestrol Acetate [usan]

    7. Org 10486-0

    8. [(8s,9s,10r,13s,14s,17r)-17-acetyl-6,13-dimethyl-3-oxo-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] Acetate

    9. Org-10486-0

    10. Mls002154113

    11. 17-alpha-acetoxy-6-methyl-19-nor-4,6-pregnadiene-3,20-dione

    12. 17-alpha-hydroxy-6-methyl-19-norpregna-4,6-diene-3,20-dione Acetate

    13. Nomegestrone Acetate

    14. 83j78v5w05

    15. Nomegestrol Acetate (usan)

    16. Nomac

    17. Lutenyl

    18. Uniplant

    19. 17-hydroxy-6-methyl-19-norpregna-4,6-diene-3,20-dione 17-acetate

    20. Lutenyl (tn)

    21. Einecs 261-379-8

    22. Unii-83j78v5w05

    23. Nomegestrol-acetate

    24. Prestwick3_001033

    25. Schembl37517

    26. Bspbio_001245

    27. Bpbio1_001370

    28. Chembl1476022

    29. Dtxsid90207349

    30. Chebi:135564

    31. Nomegestrol Acetate:17alpha-acetoxy-6alpha-methyl-19-nor-pregn-4,6-dien-3,20-dione

    32. Hms2098o07

    33. Hms2230m23

    34. Hms3715o07

    35. Bcp08358

    36. Nomegestrol Acetate [mart.]

    37. Zinc3938628

    38. Nomegestrol Acetate [who-dd]

    39. 19-norpregna-4,6-diene-3,20-dione, 17-alpha-hydroxy-6-methyl-, Acetate

    40. Akos015896563

    41. Nomegestrol Acetate, >=98% (hplc)

    42. Ac-1119

    43. Ccg-221033

    44. Db13981

    45. Hy-105634a

    46. Ncgc00179247-01

    47. Ncgc00179247-04

    48. Nomegestrol Acetate [ep Monograph]

    49. Smr001233420

    50. Ab00514012

    51. Cs-0101964

    52. D08281

    53. 652n203

    54. Sr-01000841206

    55. Q7048519

    56. Sr-01000841206-2

    57. W-105372

    58. Brd-k27351809-001-02-0

    59. (17alpha)-17-acetyl-6-methyl-3-oxoestra-4,6-dien-17-yl Acetate

    60. 17-acetoxy-6-methyl-19-norpregn-4,6-dien-3,20-dione

    61. 6-methyl-3,20-dioxo-19-norpregna-4,6-dien-17-yl Acetate

    62. Nomegestrol Acetate, European Pharmacopoeia (ep) Reference Standard

    63. 17-alpha-hydroxy-6-methyl-19-norpregna-4,6-diene-3,20-dioneacetate

    64. (8s,9s,13s,14s,17r)-17-acetyl-6,13-dimethyl-3-oxo-2,3,8,9,10,11,12,13,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-17-yl Acetate

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 370.5 g/mol
    Molecular Formula C23H30O4
    XLogP32.6
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count3
    Exact Mass370.21440943 g/mol
    Monoisotopic Mass370.21440943 g/mol
    Topological Polar Surface Area60.4 Ų
    Heavy Atom Count27
    Formal Charge0
    Complexity775
    Isotope Atom Count0
    Defined Atom Stereocenter Count6
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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