canSAR288379
FEATURES
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NAMES
    SMILES
    CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@@H](O)[C@H](N(C)C)[C@H]2O)[C@@H](CCBr)C[C@@H](C)C(=O)/C=C/C(C)=C/[C@@H]1CO[C@@H]1O[C@H](C)[C@@H](O)[C@@H](OC)[C@H]1OC
    InChI
    InChI=1S/C39H66BrNO13/c1-11-29-26(19-50-39-37(49-10)36(48-9)33(46)24(6)52-39)16-20(2)12-13-27(42)21(3)17-25(14-15-40)35(22(4)28(43)18-30(44)53-29)54-38-34(47)31(41(7)8)32(45)23(5)51-38/h12-13,16,21-26,28-29,31-39,43,45-47H,11,14-15,17-19H2,1-10H3/b13-12+,20-16+/t21-,22+,23-,24-,25+,26-,28-,29-,31+,32-,33-,34-,35-,36-,37-,38+,39-/m1/s1
    MOLECULAR FORMULA
    C39H66BrNO13
    CROSS REFERENCES
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    canSAR288379
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight835.37
    AlogP2.76
    HBond donors4
    HBond acceptors14
    Atoms120
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR288379.