392960 logo
canSAR392960
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C/C(=C\[C@@H](C)[C@H](O)[C@@H](O)/C=C/CC/C=C/C(=O)O)[C@@H](O)[C@H](C)C(=O)CCCC1CC(=O)NC(=O)C1
    InChI
    InChI=1S/C26H39NO8/c1-16(13-17(2)26(35)21(29)10-6-4-5-7-12-24(32)33)25(34)18(3)20(28)11-8-9-19-14-22(30)27-23(31)15-19/h6-7,10,12-13,17-19,21,25-26,29,34-35H,4-5,8-9,11,14-15H2,1-3H3,(H,32,33)(H,27,30,31)/b10-6+,12-7+,16-13+/t17-,18-,21+,25-,26+/m1/s1
    MOLECULAR FORMULA
    C26H39NO8
    CROSS REFERENCES
    392960 logo

    canSAR392960

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 493.27
    AlogP 2.06
    HBond donors 5
    HBond acceptors 9
    Atoms 74
    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 canSAR392960.