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    Mangiferin

    ACTIVE PHARMA INGREDIENTS

    REF. STANDARDS & IMPURITIES

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 4773-96-0, Chinonin, Alpizarin, Hedysarid, Chinomin, Aphloiol
    Molecular Formula
    C19H18O11
    Molecular Weight
    422.3  g/mol
    InChI Key
    AEDDIBAIWPIIBD-ZJKJAXBQSA-N
    FDA UNII
    1M84LD0UMD
    mangiferin is a natural product found in Salacia chinensis, Smilax bracteata, and other organisms with data available.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1,3,6,7-tetrahydroxy-2-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]xanthen-9-one
    2.1.2 InChI
    InChI=1S/C19H18O11/c20-4-11-15(25)17(27)18(28)19(30-11)12-8(23)3-10-13(16(12)26)14(24)5-1-6(21)7(22)2-9(5)29-10/h1-3,11,15,17-23,25-28H,4H2/t11-,15-,17+,18-,19+/m1/s1
    2.1.3 InChI Key
    AEDDIBAIWPIIBD-ZJKJAXBQSA-N
    2.1.4 Canonical SMILES
    C1=C2C(=CC(=C1O)O)OC3=C(C2=O)C(=C(C(=C3)O)C4C(C(C(C(O4)CO)O)O)O)O
    2.1.5 Isomeric SMILES
    C1=C2C(=CC(=C1O)O)OC3=C(C2=O)C(=C(C(=C3)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O
    2.2 Other Identifiers
    2.2.1 UNII
    1M84LD0UMD
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2-beta-d-glucopyranosyl-1,3,6,7-tetrahydroxy-9h-xanthen-9-one

    2. 9h-xanthen-9-one, 2-beta-d-glucopyranosyl-1,3,6,7-tetrahydroxy-

    3. Alpizarin

    4. Chinonin

    2.3.2 Depositor-Supplied Synonyms

    1. 4773-96-0

    2. Chinonin

    3. Alpizarin

    4. Hedysarid

    5. Chinomin

    6. Aphloiol

    7. Alpizarine

    8. Shamimin

    9. 1m84ld0umd

    10. Hedysaride

    11. Chebi:6682

    12. 2-beta-d-glucopyranosyl-1,3,6,7-tetrahydroxy-9h-xanthen-9-one

    13. (1s)-1,5-anhydro-1-(1,3,6,7-tetrahydroxy-9-oxo-9h-xanthen-2-yl)-d-glucitol

    14. 1,3,6,7-tetrahydroxy-2-((2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2h-pyran-2-yl)-9h-xanthen-9-one

    15. 9h-xanthen-9-one, 2-.beta.-d-glucopyranosyl-1,3,6,7-tetrahydroxy-

    16. Chedisaride

    17. Euxanthogen

    18. Mannipherin

    19. Chinoinin

    20. Chinomine

    21. 1,3,6,7-tetrahydroxy-2-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]xanthen-9-one

    22. 9h-xanthen-9-one, 2-beta-d-glucopyranosyl-1,3,6,7-tetrahydroxy- (9ci)

    23. Unii-1m84ld0umd

    24. Cid_5358385

    25. Mangiferol

    26. Nsc248870

    27. Nsc-248870

    28. Mangiferin,(s)

    29. Xanthone-c-glucoside

    30. Mfcd00075656

    31. Nsc 248870

    32. 9h-xanthen-9-one, 2-b-d-glucopyranosyl-1,3,6,7-tetrahydroxy-

    33. 9h-xanthen-9-one, 2-beta-d-glucopyranosyl-1,3,6,7-tetrahydroxy-

    34. Mangiferin [inci]

    35. Mangiferin Mangifera Indica

    36. Mangiferin [usp-rs]

    37. Mangiferin [who-dd]

    38. Schembl556844

    39. Mangiferin, Analytical Standard

    40. Chembl464825

    41. Bcbcmap01_000240

    42. Dtxsid60197263

    43. Hy-n0290

    44. Zinc4098535

    45. Bdbm50248691

    46. S3808

    47. Stl564509

    48. Akos015896788

    49. Ccg-268909

    50. Cs-4663

    51. Smp1_000290

    52. Ac-34484

    53. As-15337

    54. M2886

    55. N1329

    56. 773m960

    57. Mangifera Indica Bark Dry Extract [usp-rs]

    58. Q-100508

    59. Q1074417

    60. C2-beta-d-glucopyranosyl-1,3,6,7-tetrahydroxyxanthone

    61. Mangiferin, European Pharmacopoeia (ep) Reference Standard

    62. 1,3,6,7-tetrahydroxy-2-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]xanthen-9-one

    2.4 Create Date
    2005-06-24
    3 Chemical and Physical Properties
    Molecular Weight 422.3 g/mol
    Molecular Formula C19H18O11
    XLogP3-0.4
    Hydrogen Bond Donor Count8
    Hydrogen Bond Acceptor Count11
    Rotatable Bond Count2
    Exact Mass422.08491139 g/mol
    Monoisotopic Mass422.08491139 g/mol
    Topological Polar Surface Area197 Ų
    Heavy Atom Count30
    Formal Charge0
    Complexity646
    Isotope Atom Count0
    Defined Atom Stereocenter Count5
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1