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canSAR655021
FEATURES
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NAMES
    SMILES
    COc1cccc(-c2cc(C(=O)Nc3coc4c(C)c(O[C@@H]5OC(C)(C)[C@H](OC)[C@@H](O)[C@H]5O)ccc4c3=O)ccc2OC)c1
    InChI
    InChI=1S/C33H35NO10/c1-17-24(43-32-28(37)27(36)30(41-6)33(2,3)44-32)13-11-21-26(35)23(16-42-29(17)21)34-31(38)19-10-12-25(40-5)22(15-19)18-8-7-9-20(14-18)39-4/h7-16,27-28,30,32,36-37H,1-6H3,(H,34,38)/t27-,28+,30+,32+/m0/s1
    MOLECULAR FORMULA
    C33H35NO10
    CROSS REFERENCES
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    canSAR655021

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 605.23
    AlogP 4.29
    HBond donors 3
    HBond acceptors 11
    Atoms 79
    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 canSAR655021.