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    Technical details about AM20040702, learn more about the structure, uses, toxicity, action, side effects and more

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    AM20040702

    DEVELOPMENTS

    PharmaCompass

    Minakem offers CDMO services for API & HPAPI, generics, regulatory expertise, track record performance & FDA & GMP certifications.

    Temad- We think of world-class quality.

    2D Structure
    1. Also known as: 552-41-0, 2'-hydroxy-4'-methoxyacetophenone, 1-(2-hydroxy-4-methoxyphenyl)ethanone, Peonol, 2-hydroxy-4-methoxyacetophenone, Ethanone, 1-(2-hydroxy-4-methoxyphenyl)-
    Molecular Formula
    C9H10O3
    Molecular Weight
    166.17  g/mol
    InChI Key
    UILPJVPSNHJFIK-UHFFFAOYSA-N
    FDA UNII
    3R834EPI82
    paeonol is a natural product found in Vincetoxicum paniculatum, Vincetoxicum glaucescens, and other organisms with data available.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-(2-hydroxy-4-methoxyphenyl)ethanone
    2.1.2 InChI
    InChI=1S/C9H10O3/c1-6(10)8-4-3-7(12-2)5-9(8)11/h3-5,11H,1-2H3
    2.1.3 InChI Key
    UILPJVPSNHJFIK-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(=O)C1=C(C=C(C=C1)OC)O
    2.2 Other Identifiers
    2.2.1 UNII
    3R834EPI82
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2-hydroxy-4-methoxyacetophenone

    2. Peonol

    2.3.2 Depositor-Supplied Synonyms

    1. 552-41-0

    2. 2'-hydroxy-4'-methoxyacetophenone

    3. 1-(2-hydroxy-4-methoxyphenyl)ethanone

    4. Peonol

    5. 2-hydroxy-4-methoxyacetophenone

    6. Ethanone, 1-(2-hydroxy-4-methoxyphenyl)-

    7. 1-(2-hydroxy-4-methoxyphenyl)ethan-1-one

    8. 4-o-methylresacetophenone

    9. Resacetophenone-4-methyl Ether

    10. Paeonal

    11. Acetophenone, 2'-hydroxy-4'-methoxy-

    12. 4'-methoxy-2'-hydroxyacetophenone

    13. Mfcd00008730

    14. 2-acetyl-5-methoxyphenol

    15. 1-(2-hydroxy-4-methoxy-phenyl)ethanone

    16. Chembl1079227

    17. Chebi:69581

    18. 3r834epi82

    19. Nsc-401442

    20. Resacetophenone 4-o-methyl Ether

    21. 1-(2-hydroxy-4-methoxy-phenyl)-ethanone

    22. Resacetophenone, 4-o-methyl Ester

    23. Einecs 209-012-2

    24. Nsc 401442

    25. Brn 1282794

    26. 2-hydroxy-4-methoxyacetophenone (4,4,4-d3)

    27. Unii-3r834epi82

    28. Ai3-10581

    29. Paeonol (peonol)

    30. Paeonol [inci]

    31. 1-[2-hydroxy-4-(methyloxy)phenyl]ethanone

    32. Spectrum2_001981

    33. Spectrum3_001686

    34. Paeonol [who-dd]

    35. 2-acetyl-5-methoxy-phenol

    36. Cbiol_000986

    37. Bspbio_003212

    38. 4-08-00-01793 (beilstein Handbook Reference)

    39. Mls006011902

    40. Spectrum1601021

    41. Spbio_002161

    42. Schembl1449478

    43. Zinc1906

    44. Dtxsid1022059

    45. Kbio3_002432

    46. 4-methoxy 2-hydroxy Acetophenone

    47. Hms3656e07

    48. Hms3884j13

    49. 2`-hydroxy-4`-methoxyacetophenone

    50. Act07801

    51. Hy-n0159

    52. Bbl012127

    53. Bdbm50310718

    54. Ccg-39471

    55. Iccb4_000282

    56. Nsc401442

    57. S2339

    58. Stk078097

    59. Akos000119646

    60. Ac-7982

    61. Sdccgmls-0066845.p001

    62. 1-(2-hydroxy-4-methoxyphenyl)-ethanone

    63. Ncgc00095977-01

    64. Ncgc00095977-02

    65. Ncgc00095977-03

    66. 2'-hydroxy-4'-methoxyacetophenone, 99%

    67. As-15489

    68. Smr000112386

    69. Sy013508

    70. 1-(2-hydroxy-4-methoxyphenyl)ethanone #

    71. 1-(4-methoxy-2-hydroxy-phenyl)-ethanone

    72. 1-(2-hydroxy-4-methoxyphenyl)ethane-1-one

    73. Am20040702

    74. Ft-0602529

    75. Ft-0618875

    76. H0789

    77. N1847

    78. Quinuclidin-3-one Oxime Hydrochloride;paeonol

    79. Sw219250-1

    80. 1-(4-methoxy-2-hydroxyphenyl)ethanone

    81. 2-hydroxy-4-methoxyphenyl Methyl Ketone

    82. 552h410

    83. A830551

    84. Sr-05000002397

    85. Q-100626

    86. Q7124105

    87. Sr-05000002397-1

    88. Brd-k94239562-001-02-2

    89. Brd-k94239562-001-03-0

    90. 2 Inverted Exclamation Mark -hydroxy-4 Inverted Exclamation Mark -methoxyacetophenone

    91. 2 Inverted Exclamation Marka-hydroxy-4 Inverted Exclamation Marka-methoxyacetophenone

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 166.17 g/mol
    Molecular Formula C9H10O3
    XLogP32
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count2
    Exact Mass166.062994177 g/mol
    Monoisotopic Mass166.062994177 g/mol
    Topological Polar Surface Area46.5 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity167
    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 Metabolism/Metabolites

    Paeonol has known human metabolites that include (2-Acetyl-5-methoxyphenyl) hydrogen sulfate.

    S73 | METXBIODB | Metabolite Reaction Database from BioTransformer | DOI:10.5281/zenodo.4056560

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