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    CAS 22818-40-2

    MARKET PLACE

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    2D Structure
    Also known as: 22818-40-2, D(-)-4-hydroxyphenylglycine, 4-hydroxy-d-phenylglycine, H-d-phg(4-oh)-oh, D-n-(4-hydroxyphenyl)glycine, D-(-)-4-hydroxyphenylglycine
    Molecular Formula
    C8H9NO3
    Molecular Weight
    167.16  g/mol
    InChI Key
    LJCWONGJFPCTTL-SSDOTTSWSA-N
    FDA UNII
    PCM9OIX717
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2R)-2-amino-2-(4-hydroxyphenyl)acetic acid
    2.1.2 InChI
    InChI=1S/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)/t7-/m1/s1
    2.1.3 InChI Key
    LJCWONGJFPCTTL-SSDOTTSWSA-N
    2.1.4 Canonical SMILES
    C1=CC(=CC=C1C(C(=O)O)N)O
    2.1.5 Isomeric SMILES
    C1=CC(=CC=C1[C@H](C(=O)O)N)O
    2.2 Other Identifiers
    2.2.1 UNII
    PCM9OIX717
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. (r,s)-3hpg

    2. 4-hydroxyphenylglycine

    3. 4-hydroxyphenylglycine Hydrobromide, (+-)-isomer

    4. 4-hydroxyphenylglycine Hydrochloride, (r)-isomer

    5. 4-hydroxyphenylglycine Perchlorate, (+-)-isomer

    6. 4-hydroxyphenylglycine, (+-)-isomer

    7. 4-hydroxyphenylglycine, (r)-isomer

    8. 4-hydroxyphenylglycine, (s)-isomer

    9. 4-hydroxyphenylglycine, 2,4-dimethylbenzenesulfonate, (+-)-isomer

    10. 4-hydroxyphenylglycine, 2,4-dimethylbenzenesulfonate, (r)-isomer

    11. 4-hydroxyphenylglycine, 4-methylbenzenesulfonate, (+-)-isomer

    12. 4-hydroxyphenylglycine, 4-methylbenzenesulfonate, (s)-isomer

    13. 4-hydroxyphenylglycine, Monosodium Salt

    14. 4-hydroxyphenylglycine, Monosodium Salt, (r)-isomer

    15. D-p-hydroxyphenylglycine

    16. L-4-hydroxyphenylglycine

    17. Oxfenicine

    18. P-hydroxyphenylglycine

    19. Uk 25842

    20. Uk-25842

    2.3.2 Depositor-Supplied Synonyms

    1. 22818-40-2

    2. D(-)-4-hydroxyphenylglycine

    3. 4-hydroxy-d-phenylglycine

    4. H-d-phg(4-oh)-oh

    5. D-n-(4-hydroxyphenyl)glycine

    6. D-(-)-4-hydroxyphenylglycine

    7. (r)-2-amino-2-(4-hydroxyphenyl)acetic Acid

    8. (2r)-2-amino-2-(4-hydroxyphenyl)acetic Acid

    9. (r)-alpha-amino-4-hydroxybenzeneacetic Acid

    10. 4-hydroxyphenylglycine, D-(-)-

    11. (r)-2-(4-hydroxyphenyl)glycine

    12. D-p-hydroxyphenylglycine

    13. P-hydroxy-d-phenylglycine

    14. Pcm9oix717

    15. (2r)-amino(4-hydroxyphenyl)acetic Acid

    16. P-hydroxy-(r)-phenylglycine

    17. D-(-)-p-hydroxyphenylglycine

    18. Amoxicillin Related Compound I

    19. Chebi:15695

    20. Benzeneacetic Acid, A-amino-4-hydroxy-, (ar)-

    21. (r)-(4-hydroxyphenyl)glycine

    22. 4-hydroxyphenylglycine

    23. D-(-)-amino(4-hydroxyphenyl)acetic Acid

    24. (2r)-amino(4-hydroxyphenyl)ethanoic Acid

    25. D-2-amino-2-(p-hydroxyphenyl)acetic Acid

    26. D-(-)-2-(p-hydroxyphenyl)glycine

    27. (r)-ethyl 2-amino-2-(4-hydroxyphenyl)acetate

    28. Mfcd00004262

    29. Unii-pcm9oix717

    30. Benzeneacetic Acid, .alpha.-amino-4-hydroxy-, (.alpha.r)-

    31. Einecs 245-247-7

    32. Cefprozil Impurity A

    33. 4-hydroxy-d-(-)-2-phenylglycine

    34. D-4-hydroxyphenylglicyne

    35. Cefprozil Ep Impurity A

    36. Epitope Id:117718

    37. Ec 245-247-7

    38. Schembl124861

    39. D-?-(4-hydroxyphenyl)glycine

    40. Benzeneacetic Acid, Alpha-amino-4-hydroxy-, (alphar)-

    41. D-alpha-(4-hydroxyphenyl)glycine

    42. Dtxsid401014840

    43. Zinc157101

    44. 4-hydroxy-d-phenylglycine, >=98%

    45. D-(-)-2-(4-hydroxyphenyl)glycine

    46. Akos006281607

    47. Akos015924172

    48. Ac-1085

    49. Db04308

    50. D-.alpha.-p-hydroxyphenylglycine

    51. Ncgc00164509-02

    52. (-)-4-hydroxy-d-phenylglycine, 98+%

    53. As-12542

    54. Hy-34588

    55. Cefprozil Impurity A [ep Impurity]

    56. Cefadroxil Impurity A [ep Impurity]

    57. Amoxicillin Impurity I [ep Impurity]

    58. Cs-0020117

    59. Glycine, 2-(p-hydroxyphenyl)-, D-

    60. H0758

    61. Amoxicillin Related Compound I [usp-rs]

    62. C03493

    63. D71081

    64. D-(-)-.alpha.-(4-hydroxyphenyl)glycine

    65. 818h402

    66. A816374

    67. D-.alpha.-amino-4-hydroxyphenylacetic Acid

    68. Amoxicillin Trihydrate Impurity I [ep Impurity]

    69. Cefadroxil Monohydrate Impurity A [ep Impurity]

    70. Cefprozil Monohydrate Impurity A [ep Impurity]

    71. Q27095129

    72. D-(-)-.alpha.-amino-4-hydroxyphenylacetic Acid

    73. Z1762997255

    74. (r)-(-)-2-amino-2-(4-hydroxyphenyl)acetic Acid

    75. (.alpha.r)-.alpha.-amino-4-hydroxybenzeneacetic Acid

    76. Cefprozil Impurity A, European Pharmacopoeia (ep) Reference Standard

    77. (2r)-2-azaniumyl-2-(4-hydroxyphenyl)acetate;(r)-2-amino-2-(4-hydroxyphenyl)acetic Acid

    78. Amoxicillin Related Compound I, United States Pharmacopeia (usp) Reference Standard

    79. D-alpha-(4-hydroxy-phenyl)glycine, European Pharmacopoeia (ep) Reference Standard

    80. Amoxicillin Ep Impurity I; (2r)-2-amino-2-(4-hydroxyphenyl)acetic Acid; (r)-(4-hydroxyphenyl)glycine; (r)-ethyl 2-amino-2-(4-hydroxyphenyl)acetate

    2.4 Create Date
    2004-09-16
    3 Chemical and Physical Properties
    Molecular Weight 167.16 g/mol
    Molecular Formula C8H9NO3
    XLogP3-2.1
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count2
    Exact Mass167.058243149 g/mol
    Monoisotopic Mass167.058243149 g/mol
    Topological Polar Surface Area83.6 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity164
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    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

    Enzyme Inhibitors

    Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)