canSAR2093045
FEATURES
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NAMES
    SMILES
    C=C(C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(COC(=O)/C=C\c6ccc(O)cc6)[C@@H]5CC[C@]43C)[C@@H]12
    InChI
    InChI=1S/C39H56O5/c1-25(2)28-15-20-39(23-40)22-21-37(5)29(34(28)39)12-13-31-35(3)18-17-32(42)36(4,30(35)16-19-38(31,37)6)24-44-33(43)14-9-26-7-10-27(41)11-8-26/h7-11,14,28-32,34,40-42H,1,12-13,15-24H2,2-6H3/b14-9-/t28-,29+,30+,31+,32-,34+,35-,36-,37+,38+,39+/m0/s1
    MOLECULAR FORMULA
    C39H56O5
    CROSS REFERENCES
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    canSAR2093045
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight604.41
    AlogP7.94
    HBond donors3
    HBond acceptors5
    Atoms100
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2093045.