canSAR823701
FEATURES
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NAMES
    SMILES
    C=C(C)[C@@H]1CC[C@]2(COC(=O)CC3(CC(=O)O)CCCC3)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12
    InChI
    InChI=1S/C39H62O5/c1-25(2)26-12-19-39(24-44-32(43)23-38(22-31(41)42)15-8-9-16-38)21-20-36(6)27(33(26)39)10-11-29-35(5)17-14-30(40)34(3,4)28(35)13-18-37(29,36)7/h26-30,33,40H,1,8-24H2,2-7H3,(H,41,42)/t26-,27+,28-,29+,30-,33+,35-,36+,37+,39+/m0/s1
    MOLECULAR FORMULA
    C39H62O5
    CROSS REFERENCES
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    canSAR823701
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight610.46
    AlogP8.97
    HBond donors2
    HBond acceptors5
    Atoms106
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823701.