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canSAR777265
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]4C[C@]5(C)CC[C@H]6[C@H](C)CC[C@@H]([C@H]3C)[C@]64OO5)CS(=O)(=O)CCCCCCO)O[C@@H]3C[C@]4(C)CC[C@@H]1[C@@]23OO4
    InChI
    InChI=1S/C42H70O9S/c1-26-11-13-33-28(3)35(46-37-23-39(5)17-15-31(26)41(33,37)50-48-39)21-30(25-52(44,45)20-10-8-7-9-19-43)22-36-29(4)34-14-12-27(2)32-16-18-40(6)24-38(47-36)42(32,34)51-49-40/h26-38,43H,7-25H2,1-6H3/t26-,27-,28-,29-,31+,32+,33+,34+,35-,36-,37-,38-,39+,40+,41-,42-/m1/s1
    MOLECULAR FORMULA
    C42H70O9S
    CROSS REFERENCES
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    canSAR777265

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 750.47
    AlogP 7.77
    HBond donors 1
    HBond acceptors 9
    Atoms 122
    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 canSAR777265.