canSAR822589
FEATURES
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NAMES
    SMILES
    CC[C@H]1OC(=O)[C@H](C)[C@@H](OC(=O)Cc2ccc(OC)cc2)[C@H](C)[C@@H](OC2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O
    InChI
    InChI=1S/C39H63NO12/c1-13-29-39(8,46)34(44)23(4)31(42)21(2)20-38(7,48-12)35(52-37-32(43)28(40(9)10)18-22(3)49-37)24(5)33(25(6)36(45)50-29)51-30(41)19-26-14-16-27(47-11)17-15-26/h14-17,21-25,28-29,32-35,37,43-44,46H,13,18-20H2,1-12H3/t21-,22-,23+,24+,25-,28+,29-,32-,33+,34-,35-,37?,38+,39-/m1/s1
    MOLECULAR FORMULA
    C39H63NO12
    CROSS REFERENCES
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    canSAR822589
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight737.44
    AlogP3.32
    HBond donors3
    HBond acceptors13
    Atoms115
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR822589.