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    Technical details about Prestwick3_000202, learn more about the structure, uses, toxicity, action, side effects and more

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    Prestwick3_000202

    APIs // Active Pharmaceutical Ingredients

    PRICE INFORMATION

    DIGITAL CONTENT

    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
    1. Also known as: 51-24-1, 3,3',5-triiodothyroacetic acid, Triac, Triiodothyroacetic acid, Tiratricol [inn], 2-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic acid
    Molecular Formula
    C14H9I3O4
    Molecular Weight
    621.93  g/mol
    InChI Key
    UOWZUVNAGUAEQC-UHFFFAOYSA-N
    FDA UNII
    29OQ9EU4R1
    A metabolite of T3 and T4 thyroid hormones; promoted for hyperlipidemia, localized lipodystrophy, and obesity. Tiratricol has been used in trials studying the treatment of Allan-Herndon-Dudley Syndrome.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic acid
    2.1.2 InChI
    InChI=1S/C14H9I3O4/c15-9-6-8(1-2-12(9)18)21-14-10(16)3-7(4-11(14)17)5-13(19)20/h1-4,6,18H,5H2,(H,19,20)
    2.1.3 InChI Key
    UOWZUVNAGUAEQC-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC(=C(C=C1OC2=C(C=C(C=C2I)CC(=O)O)I)I)O
    2.2 Other Identifiers
    2.2.1 UNII
    29OQ9EU4R1
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 3,3',5-triiodothyroacetic Acid

    2. 3,3',5-triiodothyroacetic Acid, Sodium Salt

    3. 3,5,3'-triiodothyroacetic Acid

    4. 3,5-diiodo-3'-isopropylthyroacetic Acid

    5. Tatrois

    6. Triac

    7. Triacana

    2.3.2 Depositor-Supplied Synonyms

    1. 51-24-1

    2. 3,3',5-triiodothyroacetic Acid

    3. Triac

    4. Triiodothyroacetic Acid

    5. Tiratricol [inn]

    6. 2-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic Acid

    7. Tiracana

    8. T3-acetic Acid

    9. 3',3,5-triiodothyroacetic Acid

    10. Benzeneacetic Acid, 4-(4-hydroxy-3-iodophenoxy)-3,5-diiodo-

    11. 2-(4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl)acetic Acid

    12. Nsc-759294

    13. 3,5,3'-triiodothyroacetate

    14. Chembl41632

    15. 29oq9eu4r1

    16. Triacana

    17. 3,3',5-triiodo Thyroacetic Acid

    18. Tiratricol (inn)

    19. Cas-51-24-1

    20. 4-(4-hydroxy-3-iodophenoxy)-3,5-diiodobenzeneacetic Acid

    21. Ncgc00016227-01

    22. Teatrois

    23. Tiratricol, 3,3',5-triiodothyroacetic Acid

    24. [4-(4-hydroxy-3-iodo-phenoxy)-3,5-diiodo-phenyl]-acetic Acid

    25. Dsstox_cid_25232

    26. Dsstox_rid_80767

    27. Dsstox_gsid_45232

    28. Tiratricolum

    29. (4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl)acetic Acid

    30. [4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic Acid

    31. [4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic Acid (triiodothyroacetic Acid)

    32. 4hy

    33. Smr000058684

    34. Sr-01000003135

    35. Tiratricolum [inn-latin]

    36. Unii-29oq9eu4r1

    37. Tiracana (tn)

    38. Prestwick_439

    39. Einecs 200-086-1

    40. Mfcd00055931

    41. 1nq0

    42. Tiratricol [mi]

    43. Prestwick0_000202

    44. Prestwick1_000202

    45. Prestwick2_000202

    46. Prestwick3_000202

    47. Triiodothyroacetic Acid, 3

    48. Tiratricol [mart.]

    49. Tiratricol [who-dd]

    50. Regid_for_cid_5803

    51. Schembl25149

    52. Bspbio_000183

    53. Mls000028613

    54. Mls006010657

    55. Spbio_002104

    56. 3,3,5-triiodothyroacetic Acid

    57. Bpbio1_000203

    58. Gtpl2637

    59. Dtxsid2045232

    60. Bdbm18862

    61. 3,3',5'-triiodothyroacetic Acid

    62. Hms1568j05

    63. Hms2095j05

    64. Hms3264a05

    65. Hms3652j07

    66. Hms3712j05

    67. Pharmakon1600-01506047

    68. 2-[4-(4-hydroxy-3-iodo-phenoxy)-3,5-diiodo-phenyl]acetic Acid

    69. Amy33311

    70. Bcp07182

    71. Hy-b1201

    72. Zinc4217580

    73. Tox21_110317

    74. Tox21_303544

    75. Nsc759294

    76. S4185

    77. 3,3,5-triiodothyroaceticacid

    78. Akos015951178

    79. Ccg-213970

    80. Cs-4829

    81. Db03604

    82. Nsc 759294

    83. T3-acetic Acid [usp Impurity]

    84. Ncgc00016227-02

    85. Ncgc00016227-03

    86. Ncgc00016227-04

    87. Ncgc00016227-05

    88. Ncgc00016227-06

    89. Ncgc00016227-07

    90. Ncgc00016227-08

    91. Ncgc00257371-01

    92. As-15930

    93. 3,3',5-triiodothyroacetic Acid, >=90%

    94. Sbi-0207015.p001

    95. Ft-0675568

    96. Sw196661-4

    97. T3878

    98. Triiodothyroacetic Acid [usp Impurity]

    99. D07214

    100. 055t931

    101. Liothyronine Sodium Impurity C [ep Impurity]

    102. Q7809151

    103. Sr-01000003135-2

    104. Sr-01000003135-3

    105. Brd-k61236135-001-03-3

    106. Levothyroxine Sodium Impurity C [ep Impurity]

    107. 2-(4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl)aceticacid

    108. Levothyroxine Sodium Impurity, Triiodothyroacetic Acid, Or T3-acetic Acid-

    109. Levothyroxine Sodium Impurity, Triiodothyroacetic Acid, Or T3-acetic Acid-[usp Impurity]

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 621.93 g/mol
    Molecular Formula C14H9I3O4
    XLogP34.5
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count4
    Exact Mass621.7635 g/mol
    Monoisotopic Mass621.7635 g/mol
    Topological Polar Surface Area66.8 Ų
    Heavy Atom Count21
    Formal Charge0
    Complexity356
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 ATC Code

    D - Dermatologicals

    D11 - Other dermatological preparations

    D11A - Other dermatological preparations

    D11AX - Other dermatologicals

    D11AX08 - Tiratricol

    H - Systemic hormonal preparations, excl. sex hormones and insulins

    H03 - Thyroid therapy

    H03A - Thyroid preparations

    H03AA - Thyroid hormones

    H03AA04 - Tiratricol

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