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canSAR928895
FEATURES
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NAMES
    SMILES
    C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H](CO)O[C@H]2O[C@H]2CC[C@@]3(C)[C@@H](CC[C@@H]4[C@@H]3CC[C@@]3(C)[C@H]4C[C@@H]4O[C@]5(CC[C@@H](C)CO5)[C@@H](C)[C@@H]43)C2)[C@H](O)[C@H](O)[C@H]1O
    InChI
    InChI=1S/C44H72O16/c1-19-8-13-44(54-17-19)20(2)30-28(60-44)15-26-24-7-6-22-14-23(9-11-42(22,4)25(24)10-12-43(26,30)5)56-41-38(59-40-36(52)34(50)31(47)21(3)55-40)37(33(49)29(16-45)57-41)58-39-35(51)32(48)27(46)18-53-39/h19-41,45-52H,6-18H2,1-5H3/t19-,20+,21+,22+,23+,24-,25+,26+,27-,28+,29-,30+,31+,32+,33+,34-,35-,36-,37+,38-,39+,40+,41-,42+,43+,44-/m1/s1
    MOLECULAR FORMULA
    C44H72O16
    CROSS REFERENCES
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    canSAR928895

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 856.48
    AlogP 0.93
    HBond donors 8
    HBond acceptors 16
    Atoms 132
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR928895.