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    Lysergide D-tartrate

    DEVELOPMENTS

    PharmaCompass
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    2D Structure
    Also known as: 32426-57-6, Lysergide d-tartrate, D-lsd 25 bitartrate, 7wnp51ka7m, Lysergide tartrate, Ergoline-8-beta-carboxamide, 9,10-didehydro-n,n-diethyl-6-methyl-, tartrate (1:1), d-
    Molecular Formula
    C24H31N3O7
    Molecular Weight
    473.5  g/mol
    InChI Key
    HQMPRARIZOUKRO-JDQBHMBOSA-N
    FDA UNII
    7WNP51KA7M
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(2S,3S)-2,3-dihydroxybutanedioic acid
    2.1.2 InChI
    InChI=1S/C20H25N3O.C4H6O6/c1-4-23(5-2)20(24)14-9-16-15-7-6-8-17-19(15)13(11-21-17)10-18(16)22(3)12-14;5-1(3(7)8)2(6)4(9)10/h6-9,11,14,18,21H,4-5,10,12H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)/t14-,18-;1-,2-/m10/s1
    2.1.3 InChI Key
    HQMPRARIZOUKRO-JDQBHMBOSA-N
    2.1.4 Canonical SMILES
    CCN(CC)C(=O)C1CN(C2CC3=CNC4=CC=CC(=C34)C2=C1)C.C(C(C(=O)O)O)(C(=O)O)O
    2.1.5 Isomeric SMILES
    CCN(CC)C(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C.[C@H]([C@@H](C(=O)O)O)(C(=O)O)O
    2.2 Other Identifiers
    2.2.1 UNII
    7WNP51KA7M
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 32426-57-6

    2. Lysergide D-tartrate

    3. D-lsd 25 Bitartrate

    4. 7wnp51ka7m

    5. Lysergide Tartrate

    6. Ergoline-8-beta-carboxamide, 9,10-didehydro-n,n-diethyl-6-methyl-, Tartrate (1:1), D-

    7. (6ar,9r)-n,n-diethyl-7-methyl-6,6a,8,9-tetrahydro-4h-indolo[4,3-fg]quinoline-9-carboxamide;(2s,3s)-2,3-dihydroxybutanedioic Acid

    8. (6ar,9r)-n,n-diethyl-7-methyl-6,6a,8,9-tetrahydro-4h-indolo[4,3-fg]quinoline-9-carboxamide;2,3-dihydroxybutanedioic Acid

    9. D-9,10-didehydro-n,n-diethyl-6-methylergoline-8-beta-carboxamide Tartrate (1:1)

    10. Unii-7wnp51ka7m

    11. Lsd D-(-)-tartrate

    12. Lsd (d-tartrate) (solution)

    13. Akos040752817

    14. Ls-64353

    15. Lysergic Acid Diethylamide D-tartrate

    16. D-lysergic Acid Diethylamide D-tartrate

    17. Q27268952

    18. Ergoline-8-carboxamide, 9,10-didehydro-n,n-diethyl-6-methyl-, (8.beta.)-, (2s,3s)-2,3-dihydroxybutanedioate (1:1)

    19. Ergoline-8-carboxamide, 9,10-didehydro-n,n-diethyl-6-methyl-, (8.beta.)-, (s-(r*,r*))-2,3-dihydroxybutanedioate (1:1)

    20. Ergoline-8.beta.-carboxamide, 9,10-didehydro-n,n-diethyl-6-methyl-, (-)-tartrate (1:1)

    2.4 Create Date
    2005-08-09
    3 Chemical and Physical Properties
    Molecular Weight 473.5 g/mol
    Molecular Formula C24H31N3O7
    Hydrogen Bond Donor Count5
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count6
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area154
    Heavy Atom Count34
    Formal Charge0
    Complexity661
    Isotope Atom Count0
    Defined Atom Stereocenter Count4
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2