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canSAR828855
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NAMES
    SMILES
    CO[C@H]1C=C2[C@@H](CC[C@H](O)C2(C)C)[C@]2(C=O)CC[C@]3(C)[C@@H]([C@H](C)C/C=C/C(C)(C)OC)CC[C@@]3(C)[C@H]12
    InChI
    InChI=1S/C32H52O4/c1-21(11-10-15-28(2,3)36-9)22-14-16-31(7)27-25(35-8)19-24-23(12-13-26(34)29(24,4)5)32(27,20-33)18-17-30(22,31)6/h10,15,19-23,25-27,34H,11-14,16-18H2,1-9H3/b15-10+/t21-,22-,23-,25+,26+,27+,30-,31+,32-/m1/s1
    MOLECULAR FORMULA
    C32H52O4
    CROSS REFERENCES
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    canSAR828855

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 500.39
    AlogP 6.76
    HBond donors 1
    HBond acceptors 4
    Atoms 88
    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 canSAR828855.