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canSAR932729
FEATURES
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NAMES
    SMILES
    C=C1C[C@@H]2CC[C@@]34C[C@H]5O[C@H]6[C@@H](O3)[C@H]3O[C@H](CC[C@@H]3O[C@H]6[C@H]5O4)CC(=O)C[C@H]3[C@H](C[C@H]4O[C@@H](CC[C@@H]1O2)C[C@@H](C)C4=C)O[C@H](CC(=O)COC)[C@@H]3OC
    InChI
    InChI=1S/C41H58O12/c1-20-12-25-6-8-29-21(2)13-27(46-29)10-11-41-18-34-37(52-41)38-39(51-34)40(53-41)36-30(50-38)9-7-26(48-36)14-23(42)15-28-32(17-31(47-25)22(20)3)49-33(35(28)45-5)16-24(43)19-44-4/h20,25-40H,2-3,6-19H2,1,4-5H3/t20-,25+,26-,27+,28+,29+,30+,31-,32+,33-,34-,35-,36+,37+,38+,39-,40+,41+/m1/s1
    MOLECULAR FORMULA
    C41H58O12
    CROSS REFERENCES
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    canSAR932729

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 742.39
    AlogP 4.33
    HBond donors 0
    HBond acceptors 12
    Atoms 111
    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 canSAR932729.