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canSAR791127
FEATURES
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NAMES
    SMILES
    CCCCC/C=C/C1=C2COC(C)(C)O[C@H]2[C@H]2O[C@@]2(C/C=C(\C)C(=O)O)C1=O
    InChI
    InChI=1S/C22H30O6/c1-5-6-7-8-9-10-15-16-13-26-21(3,4)27-17(16)19-22(28-19,18(15)23)12-11-14(2)20(24)25/h9-11,17,19H,5-8,12-13H2,1-4H3,(H,24,25)/b10-9+,14-11+/t17-,19-,22+/m1/s1
    MOLECULAR FORMULA
    C22H30O6
    CROSS REFERENCES
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    canSAR791127

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 390.20
    AlogP 3.71
    HBond donors 1
    HBond acceptors 6
    Atoms 58
    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 canSAR791127.