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canSAR834077
FEATURES
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NAMES
    SMILES
    C=C1[C@H](O)CC(=C/C=C2\CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)[C@@H](CCCC)CC(C)(C)O)C[C@H]1O
    InChI
    InChI=1S/C30H50O3/c1-7-8-10-24(19-29(4,5)33)20(2)25-14-15-26-23(11-9-16-30(25,26)6)13-12-22-17-27(31)21(3)28(32)18-22/h12-13,20,24-28,31-33H,3,7-11,14-19H2,1-2,4-6H3/b23-13+/t20-,24+,25-,26+,27-,28-,30-/m1/s1
    MOLECULAR FORMULA
    C30H50O3
    CROSS REFERENCES
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    canSAR834077

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.38
    AlogP 6.73
    HBond donors 3
    HBond acceptors 3
    Atoms 83
    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 canSAR834077.