canSAR2093162
FEATURES
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NAMES
    SMILES
    COc1cc(/C=C/C(=O)O[C@H]2CC[C@@]3(C)C(=CC[C@@H]4[C@@H]3CC[C@@]3(C)[C@H]4CC[C@@H]3[C@H](C)CC[C@@H](C)C(C)C)C2)ccc1O
    InChI
    InChI=1S/C38H56O4/c1-24(2)25(3)8-9-26(4)31-14-15-32-30-13-12-28-23-29(18-20-37(28,5)33(30)19-21-38(31,32)6)42-36(40)17-11-27-10-16-34(39)35(22-27)41-7/h10-12,16-17,22,24-26,29-33,39H,8-9,13-15,18-21,23H2,1-7H3/b17-11+/t25-,26-,29+,30+,31-,32+,33+,37+,38-/m1/s1
    MOLECULAR FORMULA
    C38H56O4
    CROSS REFERENCES
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    canSAR2093162
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight576.42
    AlogP9.61
    HBond donors1
    HBond acceptors4
    Atoms98
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2093162.