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canSAR782870
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NAMES
    SMILES
    CC(=O)O[C@H]1C[C@]2(O)C3CC[C@@H]4C[C@@H](O)CC[C@]4(C)C3CC[C@]2(C)[C@H]1c1ccc(=O)oc1
    InChI
    InChI=1S/C26H36O6/c1-15(27)32-21-13-26(30)20-6-5-17-12-18(28)8-10-24(17,2)19(20)9-11-25(26,3)23(21)16-4-7-22(29)31-14-16/h4,7,14,17-21,23,28,30H,5-6,8-13H2,1-3H3/t17-,18+,19?,20?,21+,23+,24+,25-,26+/m1/s1
    MOLECULAR FORMULA
    C26H36O6
    CROSS REFERENCES
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    canSAR782870

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 444.25
    AlogP 3.78
    HBond donors 2
    HBond acceptors 6
    Atoms 68
    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 canSAR782870.