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canSAR792917
FEATURES
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NAMES
    SMILES
    CC/N=C/C1=C(O)O[C@H](COC)[C@@]2(C)C1=C(O)C(=O)C1=C2[C@H](OC(C)=O)C[C@]2(C)C(=O)CC[C@@H]12
    InChI
    InChI=1S/C25H31NO8/c1-6-26-10-13-19-22(30)21(29)18-14-7-8-16(28)24(14,3)9-15(33-12(2)27)20(18)25(19,4)17(11-32-5)34-23(13)31/h10,14-15,17,30-31H,6-9,11H2,1-5H3/b26-10+/t14-,15+,17+,24-,25-/m0/s1
    MOLECULAR FORMULA
    C25H31NO8
    CROSS REFERENCES
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    canSAR792917

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 473.20
    AlogP 2.91
    HBond donors 2
    HBond acceptors 9
    Atoms 65
    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 canSAR792917.