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canSAR834395
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NAMES
    SMILES
    COC(=O)C[C@]1(C)C[C@@](C)(CC(C)CCCC/C=C/CC/C=C\c2ccccc2)OO1
    InChI
    InChI=1S/C27H40O4/c1-23(20-26(2)22-27(3,31-30-26)21-25(28)29-4)16-12-9-7-5-6-8-10-13-17-24-18-14-11-15-19-24/h5-6,11,13-15,17-19,23H,7-10,12,16,20-22H2,1-4H3/b6-5+,17-13-/t23?,26-,27-/m1/s1
    MOLECULAR FORMULA
    C27H40O4
    CROSS REFERENCES
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    canSAR834395

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.29
    AlogP 7.06
    HBond donors 0
    HBond acceptors 4
    Atoms 71
    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 canSAR834395.