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canSAR990754
FEATURES
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NAMES
    SMILES
    CC[C@H](O)C[C@@]12[C@@H]3C[C@H]4[C@H]5[C@H](C)[C@@H]([C@H]6OC(=O)C(C)=C6OC)O[C@]5(O3)[C@@H]1CCN42
    InChI
    InChI=1S/C22H31NO6/c1-5-12(24)9-21-14-6-7-23(21)13-8-15(21)28-22(14)16(13)10(2)18(29-22)19-17(26-4)11(3)20(25)27-19/h10,12-16,18-19,24H,5-9H2,1-4H3/t10-,12-,13-,14+,15-,16+,18-,19-,21-,22+/m0/s1
    MOLECULAR FORMULA
    C22H31NO6
    CROSS REFERENCES
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    canSAR990754

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 405.22
    AlogP 1.59
    HBond donors 1
    HBond acceptors 7
    Atoms 60
    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 canSAR990754.