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canSAR1064856
FEATURES
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NAMES
    SMILES
    COC(=O)[C@@H]1[C@@H](c2ccccc2)[C@]2(c3ccc(OC)cc3)Oc3cc(C)cc(OC)c3[C@]2(O)[C@@H]1O
    InChI
    InChI=1S/C28H28O7/c1-16-14-20(33-3)24-21(15-16)35-28(18-10-12-19(32-2)13-11-18)23(17-8-6-5-7-9-17)22(26(30)34-4)25(29)27(24,28)31/h5-15,22-23,25,29,31H,1-4H3/t22-,23-,25-,27+,28+/m1/s1
    MOLECULAR FORMULA
    C28H28O7
    CROSS REFERENCES
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    canSAR1064856

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 476.18
    AlogP 3.44
    HBond donors 2
    HBond acceptors 7
    Atoms 63
    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 canSAR1064856.