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canSAR830434
FEATURES
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NAMES
    SMILES
    COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@](O)(CO)[C@H]2O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O
    InChI
    InChI=1S/C27H30O14/c1-10-3-12-17(14(30)4-10)21(33)18-13(19(12)31)5-11(37-2)6-15(18)39-25-23(22(34)20(32)16(7-28)40-25)41-26-24(35)27(36,8-29)9-38-26/h3-6,16,20,22-26,28-30,32,34-36H,7-9H2,1-2H3/t16-,20-,22+,23-,24+,25-,26+,27-/m1/s1
    MOLECULAR FORMULA
    C27H30O14
    CROSS REFERENCES
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    canSAR830434

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 578.16
    AlogP -1.87
    HBond donors 7
    HBond acceptors 14
    Atoms 71
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR830434.