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canSAR498083
FEATURES
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NAMES
    SMILES
    C=C1CCC2[C@@](C)(C(=O)OC)CCC[C@]2(C)[C@H]1CCc1ccc2c(OC(C)=O)ccc(OC(C)=O)c2c1
    InChI
    InChI=1S/C31H38O6/c1-19-8-15-28-30(4,16-7-17-31(28,5)29(34)35-6)25(19)12-10-22-9-11-23-24(18-22)27(37-21(3)33)14-13-26(23)36-20(2)32/h9,11,13-14,18,25,28H,1,7-8,10,12,15-17H2,2-6H3/t25-,28?,30+,31-/m0/s1
    MOLECULAR FORMULA
    C31H38O6
    CROSS REFERENCES
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    canSAR498083

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 506.27
    AlogP 6.57
    HBond donors 0
    HBond acceptors 6
    Atoms 75
    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 canSAR498083.