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canSAR835899
FEATURES
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NAMES
    SMILES
    C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](CC(C[C@H]3O[C@@H]4O[C@]5(C)CC[C@H]6[C@H](C)CC[C@@H]([C@H]3C)[C@]64OO5)C(=O)NCC(C)(C)C)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4
    InChI
    InChI=1S/C39H63NO9/c1-21-10-12-28-23(3)30(42-33-38(28)26(21)14-16-36(8,44-33)46-48-38)18-25(32(41)40-20-35(5,6)7)19-31-24(4)29-13-11-22(2)27-15-17-37(9)45-34(43-31)39(27,29)49-47-37/h21-31,33-34H,10-20H2,1-9H3,(H,40,41)/t21-,22-,23-,24-,26+,27+,28+,29+,30-,31-,33-,34-,36+,37+,38-,39-/m1/s1
    MOLECULAR FORMULA
    C39H63NO9
    CROSS REFERENCES
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    canSAR835899

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 689.45
    AlogP 7.05
    HBond donors 1
    HBond acceptors 10
    Atoms 112
    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 canSAR835899.