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canSAR654896
FEATURES
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NAMES
    SMILES
    CC(=O)c1c(O)c(C(C)=O)c(O)c(C(c2ccco2)c2c(O)c(C(C)=O)c(O)c(C(C)=O)c2O)c1O
    InChI
    InChI=1S/C25H22O11/c1-8(26)13-20(30)14(9(2)27)23(33)18(22(13)32)17(12-6-5-7-36-12)19-24(34)15(10(3)28)21(31)16(11(4)29)25(19)35/h5-7,17,30-35H,1-4H3
    MOLECULAR FORMULA
    C25H22O11
    CROSS REFERENCES
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    canSAR654896

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 498.12
    AlogP 3.50
    HBond donors 6
    HBond acceptors 11
    Atoms 58
    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 canSAR654896.