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

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    Dihydroberberine

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    2D Structure
    Also known as: 483-15-8, Dihydroberbine, Dihydroumbellatine, 9,10-dimethoxy-6,8-dihydro-5h-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinoline, Lambertine, 7,8-dihydroberberine
    Molecular Formula
    C20H19NO4
    Molecular Weight
    337.4  g/mol
    InChI Key
    FZAGOOYMTPGPGF-UHFFFAOYSA-N
    16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.0,.0,.0,]henicosa-1(21),2,4(8),9,15,17,19-heptaene is a natural product found in Thalictrum foliolosum, Berberis vulgaris, and Chelidonium majus with data available.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,15(20),16,18-heptaene
    2.1.2 InChI
    InChI=1S/C20H19NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-9H,5-6,10-11H2,1-2H3
    2.1.3 InChI Key
    FZAGOOYMTPGPGF-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    COC1=C(C2=C(C=C1)C=C3C4=CC5=C(C=C4CCN3C2)OCO5)OC
    2.2 Synonyms
    2.2.1 MeSH Synonyms

    1. Dihydroberberine Hydrochloride

    2.2.2 Depositor-Supplied Synonyms

    1. 483-15-8

    2. Dihydroberbine

    3. Dihydroumbellatine

    4. 9,10-dimethoxy-6,8-dihydro-5h-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinoline

    5. Lambertine

    6. 7,8-dihydroberberine

    7. Berberine, Dihydro-

    8. 9,10-dimethoxy-2,3-(methylenedioxy)-13,13a-didehydroberbine

    9. Dihydroberberine/dihydroumbellatine

    10. Berbine, 13,13a-didehydro-9,10-dimethoxy-2,3-(methylenedioxy)-

    11. 6h-benzo(g)-1,3-benzodioxolo(5,6-a)quinolizine, 5,8-dihydro-9,10-dimethoxy-

    12. Nsc331264

    13. 16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,15(20),16,18-heptaene

    14. 9,10-dimethoxy-5,8-dihydro-6h-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinoline

    15. Nsc 331264

    16. Brn 0344128

    17. Lambertin

    18. 3bti

    19. 4-27-00-06505 (beilstein Handbook Reference)

    20. Chembl11848

    21. Schembl299738

    22. Dtxsid70197476

    23. Chebi:192073

    24. Hy-n1934

    25. Zinc1575028

    26. Bdbm50480308

    27. Mfcd00022312

    28. Akos016010627

    29. Nsc-331264

    30. Ac-34205

    31. Cs-0018246

    32. Ft-0701465

    33. A14704

    34. A871933

    35. 9,10-dimethoxy-2,3-(methylenedioxy)-13,13a-didehydrob

    36. 9,10-dimethoxy-5,8-dihydro-6h-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline

    37. 9,10-dimethoxy-5,8-dihydro-6h-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline #

    38. 9,10-dimethoxy-6,8-dihydro-5h-1,3-dioxolo[4,5-g]isoquinolino[3,2-a]isoquinoline

    39. 16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.0^{2,10}.0^{4,8}.0^{15,20}]henicosa-1(21),2(10),3,8,15,17,19-heptaene

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 337.4 g/mol
    Molecular Formula C20H19NO4
    XLogP33.5
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count2
    Exact Mass337.13140809 g/mol
    Monoisotopic Mass337.13140809 g/mol
    Topological Polar Surface Area40.2 Ų
    Heavy Atom Count25
    Formal Charge0
    Complexity538
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1