canSAR633174
FEATURES
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NAMES
    SMILES
    CC1=C(O)C(=O)C2=C(C1=O)[C@@H]([C@@H](C)C/C=C/C(C)(C)O)CC[C@@H]2C
    InChI
    InChI=1S/C20H28O4/c1-11(7-6-10-20(4,5)24)14-9-8-12(2)15-16(14)17(21)13(3)18(22)19(15)23/h6,10-12,14,22,24H,7-9H2,1-5H3/b10-6+/t11-,12-,14+/m0/s1
    MOLECULAR FORMULA
    C20H28O4
    CROSS REFERENCES
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    canSAR633174
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight332.20
    AlogP3.67
    HBond donors2
    HBond acceptors4
    Atoms52
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR633174.