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canSAR1591275
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NAMES
    SMILES
    C[C@H]1C[C@@H]2OC(=O)[C@@H](C)[C@H]2CC=C1C(=O)O
    InChI
    InChI=1S/C12H16O4/c1-6-5-10-9(7(2)12(15)16-10)4-3-8(6)11(13)14/h3,6-7,9-10H,4-5H2,1-2H3,(H,13,14)/t6-,7-,9+,10-/m0/s1
    MOLECULAR FORMULA
    C12H16O4
    CROSS REFERENCES
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    canSAR1591275

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 224.10
    AlogP 1.60
    HBond donors 1
    HBond acceptors 4
    Atoms 32
    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 canSAR1591275.