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    Chemistry

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    Also known as: Canrenoic acid potassium salt, Canrenoate potassium, Soldactone, 2181-04-6, Kanrenol, Canrenoate (potassium)
    Molecular Formula
    C22H29KO4
    Molecular Weight
    396.6  g/mol
    InChI Key
    JTZQCHFUGHIPDF-RYVBEKKQSA-M
    FDA UNII
    M671F9NLEA
    Canrenoate Potassium
    A synthetic pregnadiene derivative with anti-aldosterone activity.
    1 2D Structure

    Canrenoate Potassium

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    potassium;3-[(8R,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3-oxo-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-17-yl]propanoate
    2.1.2 InChI
    InChI=1S/C22H30O4.K/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21,26)12-8-19(24)25;/h3-4,13,16-18,26H,5-12H2,1-2H3,(H,24,25);/q;+1/p-1/t16-,17+,18+,20+,21+,22-;/m1./s1
    2.1.3 InChI Key
    JTZQCHFUGHIPDF-RYVBEKKQSA-M
    2.1.4 Canonical SMILES
    CC12CCC(=O)C=C1C=CC3C2CCC4(C3CCC4(CCC(=O)[O-])O)C.[K+]
    2.1.5 Isomeric SMILES
    C[C@]12CCC(=O)C=C1C=C[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(CCC(=O)[O-])O)C.[K+]
    2.2 Other Identifiers
    2.2.1 UNII
    M671F9NLEA
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 17 Hydroxy 3 Oxo 17alpha Pregna 4,6 Diene 21 Carboxylic Acid

    2. 17-hydroxy-3-oxo-17alpha-pregna-4,6-diene-21-carboxylic Acid

    3. Acid, 17-hydroxy-3-oxo-17alpha-pregna-4,6-diene-21-carboxylic

    4. Acid, Canrenoic

    5. Canrenoate Potassium

    6. Canrenoate, Potassium

    7. Canrenoic Acid

    8. Kalium Can. Ratiopharm

    9. Kalium-can.-ratiopharm

    10. Sc 14266

    11. Sc-14266

    12. Sc14266

    13. Soldactone

    14. Soludactone

    15. Spiroctan

    2.3.2 Depositor-Supplied Synonyms

    1. Canrenoic Acid Potassium Salt

    2. Canrenoate Potassium

    3. Soldactone

    4. 2181-04-6

    5. Kanrenol

    6. Canrenoate (potassium)

    7. Canrenoic Acid Potassium

    8. Potassium Aldadiene

    9. Potassium Canrenoate [inn]

    10. M671f9nlea

    11. Canrenoate Potassium [usan]

    12. Sc-14266

    13. Mls002154212

    14. Canrenone Free Acid Potassium Salt

    15. Nsc-757789

    16. Canrenoate Potassium (usan)

    17. Soludactone

    18. Apiroctan

    19. Venactone

    20. Kalii Canrenoas

    21. Aldadiene-kalium

    22. Kalium Canrenoat

    23. Soldactone (tn)

    24. Aldadiene-potassium

    25. Canrenoato Potasico

    26. Ncgc00017146-01

    27. Prestwick_910

    28. Canrenoate De Potassium

    29. Aldadiene Potassium Salt

    30. Aldadiene-kalium [german]

    31. Unii-m671f9nlea

    32. Dsstox_cid_25602

    33. Dsstox_rid_80995

    34. Dsstox_gsid_45602

    35. Schembl49729

    36. Kalii Canrenoas [inn-latin]

    37. Potassium Canrenoate (jp17)

    38. Mf 465a

    39. Ccris 9164

    40. Chembl1371200

    41. Dtxsid2045602

    42. Hy-b1582a

    43. Canrenoato Potasico [inn-spanish]

    44. Hms1568m18

    45. Hms2095m18

    46. Hms2235n14

    47. Hms3712m18

    48. Potassium Canrenoate [jan]

    49. Einecs 218-554-9

    50. Tox21_110800

    51. Potassium Canrenoate [mart.]

    52. Canrenoate De Potassium [inn-french]

    53. Potassium Canrenoate [who-dd]

    54. Akos025402245

    55. Ac-6875

    56. Cb 8109

    57. Ccg-220148

    58. Nsc 757789

    59. Sc 14266

    60. Smr001233495

    61. Cas-2181-04-6

    62. Cs-0013479

    63. Canrenone Free Acid Potassium Salt [mi]

    64. D01943

    65. Q3655600

    66. W-107518

    67. Potassium 17-hydroxy-3-oxo-17-alpha-pregna-4,6-diene-21-carboxylate

    68. Potassium 17-hydroxy-3-oxo-17alpha-pregna-4,6-diene-21-carboxylate

    69. Potassium 3-(17-beta-hydroxy-3-oxoandrosta-4,6-dien-17-yl)propionate

    70. 17-alpha-pregna-4,6-diene-21-carboxylic Acid, 17-hydroxy-3-oxo-, Monopotassium Salt

    71. Potassium 17-hydroxy-3-oxo-17.alpha.-pregna-4,6-diene-21-carboxylate

    72. Potassium 3-(3-oxo-17-beta-hydroxy-4,6-androstadien-17-alpha-yl)propanoate

    73. Pregna-4,6-diene-21-carboxylic Acid, 17-hydroxy-3-oxo-, Monopotassium Salt (17alpha)-

    74. Pregna-4,6-diene-21-carboxylic Acid, 17-hydroxy-3-oxo-, Monopotassium Salt (17.alpha.)-

    2.4 Create Date
    2008-02-05
    3 Chemical and Physical Properties
    Molecular Weight 396.6 g/mol
    Molecular Formula C22H29KO4
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count3
    Exact Mass396.17029089 g/mol
    Monoisotopic Mass396.17029089 g/mol
    Topological Polar Surface Area77.4 Ų
    Heavy Atom Count27
    Formal Charge0
    Complexity713
    Isotope Atom Count0
    Defined Atom Stereocenter Count6
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Mineralocorticoid Receptor Antagonists

    Drugs that bind to and block the activation of MINERALOCORTICOID RECEPTORS by MINERALOCORTICOIDS such as ALDOSTERONE. (See all compounds classified as Mineralocorticoid Receptor Antagonists.)

    4.2 ATC Code

    C - Cardiovascular system

    C03 - Diuretics

    C03D - Aldosterone antagonists and other potassium-sparing agents

    C03DA - Aldosterone antagonists

    C03DA02 - Potassium canrenoate

    API Reference Price

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    05-Feb-2021
    14-Aug-2024
    KGS
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