780646 logo
canSAR780646
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CC(O)CO)[C@H]2O)[C@](C)(O)C[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@]1(C)O
    InChI
    InChI=1S/C39H73NO15/c1-13-27-39(10,49)32(45)21(4)29(43)19(2)15-37(8,48)34(55-36-30(44)26(14-20(3)51-36)40(11)17-25(42)18-41)22(5)31(23(6)35(47)53-27)54-28-16-38(9,50-12)33(46)24(7)52-28/h19-34,36,41-46,48-49H,13-18H2,1-12H3/t19-,20-,21+,22+,23-,24+,25?,26+,27-,28-,29+,30-,31+,32-,33+,34-,36+,37-,38-,39-/m1/s1
    MOLECULAR FORMULA
    C39H73NO15
    CROSS REFERENCES
    780646 logo

    canSAR780646

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 795.50
    AlogP 0.30
    HBond donors 8
    HBond acceptors 16
    Atoms 128
    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 canSAR780646.