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canSAR793064
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NAMES
    SMILES
    C[C@@]12CC[C@@]3(O)[C@]4(C)[C@@H](O)CC[C@@](C)(C(=O)O)[C@H]4CC[C@]3(CC1=O)C2
    InChI
    InChI=1S/C20H30O5/c1-16-8-9-20(25)18(3)12(4-7-19(20,11-16)10-14(16)22)17(2,15(23)24)6-5-13(18)21/h12-13,21,25H,4-11H2,1-3H3,(H,23,24)/t12-,13+,16+,17-,18+,19+,20-/m1/s1
    MOLECULAR FORMULA
    C20H30O5
    CROSS REFERENCES
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    canSAR793064

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 350.21
    AlogP 2.53
    HBond donors 3
    HBond acceptors 5
    Atoms 55
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR793064.