846466 logo
canSAR846466
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C=C[C@@]1(C)CC(=O)[C@@]23OC(=O)O[C@H]4CCC(C)(C)[C@H](C(O)C(OC(C)=O)[C@@]2(C)O1)C43C
    InChI
    InChI=1S/C23H32O8/c1-8-20(5)11-13(25)23-21(6)14(29-18(27)30-23)9-10-19(3,4)16(21)15(26)17(28-12(2)24)22(23,7)31-20/h8,14-17,26H,1,9-11H2,2-7H3/t14-,15?,16-,17?,20-,21?,22+,23-/m0/s1
    MOLECULAR FORMULA
    C23H32O8
    CROSS REFERENCES
    846466 logo

    canSAR846466

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 436.21
    AlogP 2.70
    HBond donors 1
    HBond acceptors 8
    Atoms 63
    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 canSAR846466.