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canSAR929371
FEATURES
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NAMES
    SMILES
    COC(=O)[C@@]12OC[C@@]34[C@H]1[C@@H](OC(=O)C=C(C)C)C(=O)O[C@@H]3C[C@H]1[C@H](C)C(=O)C(OC3OC(CO)C(O)C(O)C3O)=C[C@]1(C)[C@H]4[C@@H](O)[C@@H]2O
    InChI
    InChI=1S/C32H42O16/c1-11(2)6-17(34)48-23-25-31-10-44-32(25,29(42)43-5)26(40)22(39)24(31)30(4)8-14(18(35)12(3)13(30)7-16(31)47-27(23)41)45-28-21(38)20(37)19(36)15(9-33)46-28/h6,8,12-13,15-16,19-26,28,33,36-40H,7,9-10H2,1-5H3/t12-,13-,15?,16+,19?,20?,21?,22+,23+,24+,25+,26-,28?,30-,31+,32-/m0/s1
    MOLECULAR FORMULA
    C32H42O16
    CROSS REFERENCES
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    canSAR929371

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 682.25
    AlogP -2.37
    HBond donors 6
    HBond acceptors 16
    Atoms 90
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR929371.