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canSAR922799
FEATURES
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NAMES
    SMILES
    C=C(C=O)[C@H](C)[C@@H]1CCC23CC12CC[C@@H]1[C@@]2(C)CC[C@@H](OC(C)=O)C(C)(C)[C@@H]2C[C@@H](OC2OC(COC(C)=O)C(O)C(O)C2O)[C@]13C
    InChI
    InChI=1S/C37H56O10/c1-19(16-38)20(2)23-9-14-37-18-36(23,37)13-10-25-34(7)12-11-27(45-22(4)40)33(5,6)26(34)15-28(35(25,37)8)47-32-31(43)30(42)29(41)24(46-32)17-44-21(3)39/h16,20,23-32,41-43H,1,9-15,17-18H2,2-8H3/t20-,23-,24?,25+,26-,27+,28+,29?,30?,31?,32?,34+,35-,36?,37?/m0/s1
    MOLECULAR FORMULA
    C37H56O10
    CROSS REFERENCES
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    canSAR922799

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 660.39
    AlogP 4.11
    HBond donors 3
    HBond acceptors 10
    Atoms 103
    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 canSAR922799.