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    Diindolylmethane

    ACTIVE PHARMA INGREDIENTS

    DIGITAL CONTENT

    MARKET PLACE

    PharmaCompass
    $ API Ref.Price (USD/KG) : 58Xls

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    2D Structure
    Also known as: 1968-05-4, Diindolylmethane, Di(1h-indol-3-yl)methane, 3,3'-methylenebis-1h-indole, 3,3'-methylenediindole, Dim
    Molecular Formula
    C17H14N2
    Molecular Weight
    246.31  g/mol
    InChI Key
    VFTRKSBEFQDZKX-UHFFFAOYSA-N
    FDA UNII
    SSZ9HQT61Z
    Diindolylmethane is a phytonutrient and plant indole found in cruciferous vegetables including broccoli, Brussels sprouts, cabbage, cauliflower and kale, with potential anti-androgenic and antineoplastic activities. As a dimer of indole-3-carbinol, diindolylmethane (DIM) promotes beneficial estrogen metabolism in both sexes by reducing the levels of 16-hydroxy estrogen metabolites and increasing the formation of 2-hydroxy estrogen metabolites, resulting in increased antioxidant activity. Although this agent induces apoptosis in tumor cells in vitro, the exact mechanism by which DIM exhibits its antineoplastic activity in vivo is unknown.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-(1H-indol-3-ylmethyl)-1H-indole
    2.1.2 InChI
    InChI=1S/C17H14N2/c1-3-7-16-14(5-1)12(10-18-16)9-13-11-19-17-8-4-2-6-15(13)17/h1-8,10-11,18-19H,9H2
    2.1.3 InChI Key
    VFTRKSBEFQDZKX-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC=C2C(=C1)C(=CN2)CC3=CNC4=CC=CC=C43
    2.2 Other Identifiers
    2.2.1 UNII
    SSZ9HQT61Z
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2,2'-methylenebis(1h-indole)

    2. Diindolylmethane

    2.3.2 Depositor-Supplied Synonyms

    1. 1968-05-4

    2. Diindolylmethane

    3. Di(1h-indol-3-yl)methane

    4. 3,3'-methylenebis-1h-indole

    5. 3,3'-methylenediindole

    6. Dim

    7. Arundine

    8. 3-(1h-indol-3-ylmethyl)-1h-indole

    9. 1h-indole, 3,3'-methylenebis-

    10. Di(3-indolyl)methane

    11. 3,3'-di-indolylmethane

    12. Plant Indole

    13. 3,3'-methylenebis(1h-indole)

    14. 3,3,-diindolylmethane

    15. Mfcd00195766

    16. Ssz9hqt61z

    17. Bis-1h-indol-3-ylmethane

    18. Chebi:50182

    19. 3,3'-methanediylbis(1h-indole)

    20. Hb 236

    21. 3,3 Inverted Exclamation Marka-diindolylmethane

    22. 3-diindolyl Methane

    23. 3,3'-diindolymethane

    24. Diidolylmethane

    25. Infemin

    26. Ccris 5806

    27. 33diindolylmethyle

    28. Di-3-indolylmethane

    29. Nsc708486

    30. 3-3-diindolylmethane

    31. 33'-diindolylmethane

    32. Spectrum2_001711

    33. Spectrum3_001989

    34. Spectrum5_001955

    35. Unii-ssz9hqt61z

    36. Cbiol_001839

    37. Oprea1_472633

    38. Oprea1_740951

    39. Bspbio_001290

    40. Bspbio_003589

    41. Cbdive_010856

    42. Kbiogr_000010

    43. Kbioss_000010

    44. Mls006011847

    45. Schembl325162

    46. Spectrum1505331

    47. Spbio_001722

    48. 3,3'-di(indol-3-yl)methane

    49. Bml3-f11

    50. Chembl446452

    51. 3,3'-diindolylmethane (dim)

    52. Diindolylmethane [vandf]

    53. Dtxsid8037047

    54. Gtpl11208

    55. Kbio2_000010

    56. Kbio2_002578

    57. Kbio2_005146

    58. Kbio3_000019

    59. Kbio3_000020

    60. Kbio3_003002

    61. Bio1_000125

    62. Bio1_000614

    63. Bio1_001103

    64. Bio2_000010

    65. Bio2_000490

    66. Diindolylmethane, 3,3'-

    67. Hms1361a12

    68. Hms1791a12

    69. Hms1989a12

    70. Hms3402a12

    71. Zinc187911

    72. 3,3'-diindolylmethane, Aldrichcpr

    73. Act06989

    74. Albb-016048

    75. Bcp00470

    76. Ccg-39861

    77. Gr-207

    78. Hsci1_000069

    79. S4728

    80. Stk263696

    81. Akos003627372

    82. Am84671

    83. Cs-1652

    84. Db11875

    85. Ks-5266

    86. Nsc-708486

    87. Sb16901

    88. Idi1_033760

    89. 3,3'-diindolylmethane [who-dd]

    90. Ncgc00095348-01

    91. Ncgc00095348-02

    92. Ncgc00095348-03

    93. Ncgc00095348-04

    94. Ncgc00095348-05

    95. Ncgc00095348-06

    96. Ncgc00095348-07

    97. Ac-11611

    98. Hy-15758

    99. Nci60_038418

    100. Smr001828114

    101. Sy038972

    102. 3,3'-diindolylmethane, >=98% (hplc)

    103. 3,3'-diindolylmethane, Analytical Standard

    104. Db-011102

    105. Ft-0614061

    106. M1399

    107. A16321

    108. D-3720

    109. 968d054

    110. Q4634053

    111. Brd-k37846922-001-05-2

    112. Brd-k37846922-001-06-0

    113. Brd-k37846922-001-09-4

    114. C444299000

    2.4 Create Date
    2005-03-25
    3 Chemical and Physical Properties
    Molecular Weight 246.31 g/mol
    Molecular Formula C17H14N2
    XLogP34.3
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count0
    Rotatable Bond Count2
    Exact Mass246.115698455 g/mol
    Monoisotopic Mass246.115698455 g/mol
    Topological Polar Surface Area31.6 Ų
    Heavy Atom Count19
    Formal Charge0
    Complexity286
    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 MeSH Pharmacological Classification

    Anticarcinogenic Agents

    Agents that reduce the frequency or rate of spontaneous or induced tumors independently of the mechanism involved. (See all compounds classified as Anticarcinogenic Agents.)