canSAR1808820
FEATURES
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NAMES
    SMILES
    C[C@@H]1C[C@H](O)[C@@H](O)[C@@]2(O[C@H](CC(=O)O)CC3=C2C(=O)c2c(O)cccc2C3=O)O1
    InChI
    InChI=1S/C20H20O9/c1-8-5-13(22)19(27)20(28-8)16-11(6-9(29-20)7-14(23)24)17(25)10-3-2-4-12(21)15(10)18(16)26/h2-4,8-9,13,19,21-22,27H,5-7H2,1H3,(H,23,24)/t8-,9+,13+,19-,20-/m1/s1
    MOLECULAR FORMULA
    C20H20O9
    CROSS REFERENCES
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    canSAR1808820
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight404.11
    AlogP0.56
    HBond donors4
    HBond acceptors9
    Atoms49
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1808820.