832877 logo
canSAR832877
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COC(=O)[C@@]1(CC(=O)O)CC[C@]2(C)[C@H](CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@]32C)C1=O
    InChI
    InChI=1S/C29H44O7/c1-17(30)36-21-11-12-26(4)19(25(21,2)3)10-13-28(6)20(26)9-8-18-23(33)29(16-22(31)32,24(34)35-7)15-14-27(18,28)5/h18-21H,8-16H2,1-7H3,(H,31,32)/t18-,19+,20-,21+,26+,27-,28-,29-/m1/s1
    MOLECULAR FORMULA
    C29H44O7
    CROSS REFERENCES
    832877 logo

    canSAR832877

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 504.31
    AlogP 5.19
    HBond donors 1
    HBond acceptors 7
    Atoms 80
    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 canSAR832877.