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canSAR830782
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NAMES
    SMILES
    C=C(C)[C@]12C[C@@H](C)[C@@]34O[C@](Cc5ccccc5)(O[C@@H]1[C@@H]3C=C(COC(=O)Oc1ccc(O)c(OC)c1)C[C@]1(O)C(=O)C(C)=C[C@H]14)O2
    InChI
    InChI=1S/C36H38O10/c1-20(2)34-16-22(4)36-26(31(34)44-35(45-34,46-36)18-23-9-7-6-8-10-23)14-24(17-33(40)29(36)13-21(3)30(33)38)19-42-32(39)43-25-11-12-27(37)28(15-25)41-5/h6-15,22,26,29,31,37,40H,1,16-19H2,2-5H3/t22-,26+,29-,31-,33-,34-,35-,36-/m1/s1
    MOLECULAR FORMULA
    C36H38O10
    CROSS REFERENCES
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    canSAR830782

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 630.25
    AlogP 5.17
    HBond donors 2
    HBond acceptors 10
    Atoms 84
    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 canSAR830782.