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canSAR777790
FEATURES
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NAMES
    SMILES
    CC(=O)OC1(C2/C(C)=C(/O)C(=O)C3=C(C)C(OC(=O)C(O)C(CC(C)C)NC(=O)OC(C)(C)C)CC(O)(C2OC(=O)c2ccccc2)C3(C)C)COC1CCO
    InChI
    InChI=1S/C41H57NO14/c1-21(2)18-26(42-37(50)56-38(6,7)8)32(46)36(49)53-27-19-41(51)34(54-35(48)25-14-12-11-13-15-25)30(40(55-24(5)44)20-52-28(40)16-17-43)23(4)31(45)33(47)29(22(27)3)39(41,9)10/h11-15,21,26-28,30,32,34,43,45-46,51H,16-20H2,1-10H3,(H,42,50)/b31-23+/t26-,27-,28-,30+,32+,34-,40-,41+/m0/s1
    MOLECULAR FORMULA
    C41H57NO14
    CROSS REFERENCES
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    canSAR777790

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 787.38
    AlogP 4.02
    HBond donors 5
    HBond acceptors 15
    Atoms 113
    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 canSAR777790.