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canSAR837059
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NAMES
    SMILES
    C/C=C1\CN2[C@H]3C[C@@H]1[C@@]1(C(=O)OC)C(OC(=O)c4cc(OC)c(OC)c(OC)c4)[C@]4(C[C@H]21)c1ccccc1N(C)[C@H]34
    InChI
    InChI=1S/C32H36N2O7/c1-7-17-16-34-22-14-20(17)32(30(36)40-6)25(34)15-31(19-10-8-9-11-21(19)33(2)27(22)31)29(32)41-28(35)18-12-23(37-3)26(39-5)24(13-18)38-4/h7-13,20,22,25,27,29H,14-16H2,1-6H3/b17-7+/t20-,22-,25-,27+,29?,31+,32-/m0/s1
    MOLECULAR FORMULA
    C32H36N2O7
    CROSS REFERENCES
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    canSAR837059

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 560.25
    AlogP 3.59
    HBond donors 0
    HBond acceptors 9
    Atoms 77
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR837059.