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canSAR165077
FEATURES
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NAMES
    SMILES
    COc1ccc(C(=O)O[C@H]2[C@@H]3[C@]4(OC(C)=O)COC4C[C@H](O)[C@@]3(C)C(=O)[C@H](OC(C)=O)C3=C(C)[C@@H](OC(=O)[C@H](O)[C@@H](NC(=O)c4ccccc4)c4ccccc4)C[C@]2(O)C3(C)C)cc1
    InChI
    InChI=1S/C48H53NO15/c1-25-32(62-44(57)37(53)36(28-14-10-8-11-15-28)49-42(55)29-16-12-9-13-17-29)23-48(58)41(63-43(56)30-18-20-31(59-7)21-19-30)39-46(6,33(52)22-34-47(39,24-60-34)64-27(3)51)40(54)38(61-26(2)50)35(25)45(48,4)5/h8-21,32-34,36-39,41,52-53,58H,22-24H2,1-7H3,(H,49,55)/t32-,33-,34?,36-,37+,38+,39-,41-,46+,47-,48+/m0/s1
    MOLECULAR FORMULA
    C48H53NO15
    CROSS REFERENCES
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    canSAR165077

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 883.34
    AlogP 3.74
    HBond donors 4
    HBond acceptors 16
    Atoms 117
    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 canSAR165077.