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canSAR1435531
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCCCCCCCCCC(=O)OC[C@@]1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13C=C[C@@](C)(CC[C@@H]21)C3
    InChI
    InChI=1S/C40H70O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-36(41)42-33-38(3)26-22-27-39(4)34(38)25-29-40-31-30-37(2,32-40)28-24-35(39)40/h30-31,34-35H,5-29,32-33H2,1-4H3/t34-,35+,37-,38-,39-,40+/m1/s1
    MOLECULAR FORMULA
    C40H70O2
    CROSS REFERENCES
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    canSAR1435531

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 582.54
    AlogP 12.54
    HBond donors 0
    HBond acceptors 2
    Atoms 112
    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 canSAR1435531.