canSAR635753
FEATURES
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NAMES
    SMILES
    Cc1c(O)c(OC2OC(CO)C(O)C(O)C2O)cc2c1CC[C@H]1[C@]3(C)C[C@@H](O)[C@H]([C@@](C)(O)C(=O)CCC(C)(C)O)[C@@]3(C)CC(=O)[C@@]21C
    InChI
    InChI=1S/C35H52O12/c1-16-17-8-9-22-32(4)13-19(37)29(35(7,45)23(38)10-11-31(2,3)44)33(32,5)14-24(39)34(22,6)18(17)12-20(25(16)40)46-30-28(43)27(42)26(41)21(15-36)47-30/h12,19,21-22,26-30,36-37,40-45H,8-11,13-15H2,1-7H3/t19-,21?,22+,26?,27?,28?,29+,30?,32+,33-,34+,35+/m1/s1
    MOLECULAR FORMULA
    C35H52O12
    CROSS REFERENCES
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    canSAR635753
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight664.35
    AlogP0.94
    HBond donors8
    HBond acceptors12
    Atoms99
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR635753.