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    Glabridin

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
    $ API Ref.Price (USD/KG) : 5,407Xls

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    2D Structure
    Also known as: 59870-68-7, 4-[(3r)-8,8-dimethyl-3,4-dihydro-2h-pyrano[2,3-f]chromen-3-yl]benzene-1,3-diol, 4-(3,4-dihydro-8,8-dimethyl-2h,8h-benzo(1,2-b:3,4-b')dipyran-3-yl)-1,3-benzenediol, Chebi:5369, Hoc5567t41, (r)-4-(8,8-dimethyl-2,3,4,8-tetrahydropyrano[2,3-f]chromen-3-yl)benzene-1,3-diol
    Molecular Formula
    C20H20O4
    Molecular Weight
    324.4  g/mol
    InChI Key
    LBQIJVLKGVZRIW-ZDUSSCGKSA-N
    FDA UNII
    HOC5567T41
    glabridin is a natural product found in Ornithopus sativus, Glycyrrhiza glabra, and Glycyrrhiza uralensis with data available.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[2,3-f]chromen-3-yl]benzene-1,3-diol
    2.1.2 InChI
    InChI=1S/C20H20O4/c1-20(2)8-7-16-18(24-20)6-3-12-9-13(11-23-19(12)16)15-5-4-14(21)10-17(15)22/h3-8,10,13,21-22H,9,11H2,1-2H3/t13-/m0/s1
    2.1.3 InChI Key
    LBQIJVLKGVZRIW-ZDUSSCGKSA-N
    2.1.4 Canonical SMILES
    CC1(C=CC2=C(O1)C=CC3=C2OCC(C3)C4=C(C=C(C=C4)O)O)C
    2.1.5 Isomeric SMILES
    CC1(C=CC2=C(O1)C=CC3=C2OC[C@H](C3)C4=C(C=C(C=C4)O)O)C
    2.2 Other Identifiers
    2.2.1 UNII
    HOC5567T41
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 4-(3,4-dihydro-8,8-dimethyl-2h,8h-benzo(1,2-b:3,4-b')dipyran-3-yl)-1,3-benzenediol

    2.3.2 Depositor-Supplied Synonyms

    1. 59870-68-7

    2. 4-[(3r)-8,8-dimethyl-3,4-dihydro-2h-pyrano[2,3-f]chromen-3-yl]benzene-1,3-diol

    3. 4-(3,4-dihydro-8,8-dimethyl-2h,8h-benzo(1,2-b:3,4-b')dipyran-3-yl)-1,3-benzenediol

    4. Chebi:5369

    5. Hoc5567t41

    6. (r)-4-(8,8-dimethyl-2,3,4,8-tetrahydropyrano[2,3-f]chromen-3-yl)benzene-1,3-diol

    7. 1,3-benzenediol, 4-(3,4-dihydro-8,8-dimethyl-2h,8h-benzo(1,2-b:3,4-b')dipyran-3-yl)-, (r)-

    8. Q-100692

    9. (r)-glabridin

    10. (r)-4-(8,8-dimethyl-3,4-dihydro-2h,8h-pyrano[2,3-f]chromen-3-yl)benzene-1,3-diol

    11. 4-[(3r)-8,8-dimethyl-2h,3h,4h,8h-pyrano[2,3-f]chromen-3-yl]benzene-1,3-diol

    12. 4-[(3r)-8,8-dimethyl-3,4-dihydro-2h,8h-pyrano[2,3-f]chromen-3-yl]benzene-1,3-diol

    13. Glabioidin

    14. Unii-hoc5567t41

    15. 1,3-benzenediol, 4-((3r)-3,4-dihydro-8,8-dimethyl-2h,8h-benzo(1,2-b:3,4-b')dipyran-3-yl)-

    16. 1,3-benzenediol, 4-[(3r)-3,4-dihydro-8,8-dimethyl-2h,8h-benzo[1,2-b:3,4-b']dipyran-3-yl]-

    17. Mfcd03427694

    18. Ls-176045

    19. Glabridin [inci]

    20. Glabridin [who-dd]

    21. Mls000697609

    22. Bidd:er0172

    23. Glabridin, Analytical Standard

    24. Schembl114869

    25. Amy381

    26. Chembl480477

    27. Dtxsid00208589

    28. Hms2271g14

    29. Hms3885m04

    30. Hy-n0393

    31. Zinc4098719

    32. Bdbm50441626

    33. Lmpk12080012

    34. S3786

    35. Stl566095

    36. Akos015903270

    37. Glabridin, >=98% (hplc), Powder

    38. Ccg-223443

    39. 4-[(3r)-3,4-dihydro-8,8-dimethyl-2h,8h-benzo[1,2-b:3,4-b']dipyran-3-yl]-1,3-benzenediol

    40. Ncgc00247524-01

    41. Ac-31452

    42. As-74264

    43. Smr000470944

    44. Kb-289522

    45. Cs-0008929

    46. N1579

    47. 870g687

    48. A913838

    49. Q2386110

    50. 4-[(3r)-8,8-dimethyl-3,4-dihydro-2h-pyrano[2,3-f]chromen- 3-yl]benzene-1,3-diol

    51. 4-[(3r)-8,8-dimethyl-3,4-dihydro-2h-pyrano[6,5-f]chromen-3-yl]benzene-1,3-diol

    52. 1,3-benzenediol,4-(3,4-dihydro-8,8-dimethyl-2h,8h-benzo(1,2-b:3,4-b')dipyran-3-yl)-,(r); 4-(3,4-dihydro-8,8-dimethyl-2h,8h-benzo(1,2-b:3,4-b')dipyran-3-yl)-1,3-benzenediol

    53. 1,3-benzenediol,4-(3,4-dihydro-8,8-dimethyl-2h,8h-benzo[1,2-b:3,4-b']dipyran-3-yl)-,(r)-

    54. 4-((r)-8,8-dimethyl-3,4-dihydro-2h,8h-benzo[1,2-b:4,3-b']dipyran-3-yl)-benzene-1,3-diol

    55. 4-[(3r)-8,8-dimethyl-3,4-dihydro-2h,8h-benzo[1,2-b:3,4-b']dipyran-3-yl]benzene-1,3-diol

    2.4 Create Date
    2005-06-24
    3 Chemical and Physical Properties
    Molecular Weight 324.4 g/mol
    Molecular Formula C20H20O4
    XLogP33.9
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count1
    Exact Mass324.13615911 g/mol
    Monoisotopic Mass324.13615911 g/mol
    Topological Polar Surface Area58.9 Ų
    Heavy Atom Count24
    Formal Charge0
    Complexity488
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1