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    Chemistry

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    Also known as: 519-02-8, (+)-matrine, Matridin-15-one, Matrinium, Vegard, (7as,13ar,13br,13cs)-dodecahydro-1h,5h,10h-dipyrido[2,1-f:3',2',1'-ij][1,6]naphthyridin-10-one
    Molecular Formula
    C15H24N2O
    Molecular Weight
    248.36  g/mol
    InChI Key
    ZSBXGIUJOOQZMP-JLNYLFASSA-N
    FDA UNII
    N390W430AC
    Matrine
    Tetracyclic bis-quinolizidine alkaloids found in the family LEGUMINOSAE, mainly in the genus SOPHORA.
    1 2D Structure

    Matrine

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (1R,2R,9S,17S)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one
    2.1.2 InChI
    InChI=1S/C15H24N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h11-13,15H,1-10H2/t11-,12+,13+,15-/m0/s1
    2.1.3 InChI Key
    ZSBXGIUJOOQZMP-JLNYLFASSA-N
    2.1.4 Canonical SMILES
    C1CC2C3CCCN4C3C(CCC4)CN2C(=O)C1
    2.1.5 Isomeric SMILES
    C1C[C@@H]2[C@H]3CCCN4[C@H]3[C@@H](CCC4)CN2C(=O)C1
    2.2 Other Identifiers
    2.2.1 UNII
    N390W430AC
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Matrine Alkaloids

    2. Matrine Type Alkaloids

    3. Matrine, (5beta)-isomer

    4. Matrine-type Alkaloids

    5. Matrines

    6. Sophoridine

    2.3.2 Depositor-Supplied Synonyms

    1. 519-02-8

    2. (+)-matrine

    3. Matridin-15-one

    4. Matrinium

    5. Vegard

    6. (7as,13ar,13br,13cs)-dodecahydro-1h,5h,10h-dipyrido[2,1-f:3',2',1'-ij][1,6]naphthyridin-10-one

    7. Chebi:6700

    8. Matrene, (+)-

    9. .alpha.-matrine

    10. N390w430ac

    11. Nsc-146051

    12. Nsc 146051

    13. Brn 0085851

    14. Alpha-matrine

    15. Cis-neomatrine

    16. Unii-n390w430ac

    17. Trans-neomatrine

    18. A-matrine

    19. Nsc-318810

    20. Matrine,(s)

    21. Matrine [inci]

    22. Matrine [mi]

    23. Matrine ((+)-matrine)

    24. Matrine [who-dd]

    25. 5-24-02-00301 (beilstein Handbook Reference)

    26. Schembl177907

    27. Chembl204860

    28. Dtxsid00274188

    29. Hms3884f13

    30. Amy25701

    31. Bcp08193

    32. Hy-n0164

    33. Zinc2083329

    34. Matrine 100 Microg/ml In Methanol

    35. Bdbm50249581

    36. Mfcd02735434

    37. Nsc146051

    38. S2322

    39. Matridin-15-one;vegard;alpha-matrine

    40. Akos007930266

    41. Ccg-208589

    42. Cs-1601

    43. Ks-5203

    44. Ncgc00346593-01

    45. M2120

    46. N1836

    47. 19m028

    48. (1r,2r,9s,17s)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one

    49. (7as,13ar,13bs,13cs)dodecahydro-1h,5h,10h-dipyrido[2,1-f:3,2,1-ij][1,6]naphthyridin-10-one

    50. 1h,5h,10h-dipyrido(2,1-f:3',2',1'-ij)(1,6)naphthyridin-10-one, Dodecahydro-, (7as,13ar,13br,13cs)-

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 248.36 g/mol
    Molecular Formula C15H24N2O
    XLogP31.6
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count0
    Exact Mass248.188863393 g/mol
    Monoisotopic Mass248.188863393 g/mol
    Topological Polar Surface Area23.6 Ų
    Heavy Atom Count18
    Formal Charge0
    Complexity356
    Isotope Atom Count0
    Defined Atom Stereocenter Count4
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

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