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canSAR393581
FEATURES
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NAMES
    SMILES
    O=C(O)/C=C\C=C\C1(O)[C@H](O)CCC[C@H]1O
    InChI
    InChI=1S/C11H16O5/c12-8-4-3-5-9(13)11(8,16)7-2-1-6-10(14)15/h1-2,6-9,12-13,16H,3-5H2,(H,14,15)/b6-1-,7-2+/t8-,9-/m1/s1
    MOLECULAR FORMULA
    C11H16O5
    CROSS REFERENCES
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    canSAR393581

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 228.10
    AlogP -0.18
    HBond donors 4
    HBond acceptors 5
    Atoms 32
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR393581.