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canSAR841097
FEATURES
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NAMES
    SMILES
    C=C1C(=O)[C@@]23[C@@H](CC[C@H]1[C@H]2OC(=O)CN)[C@@]12CO[C@]3(O)[C@@H](O)[C@@H]1C(C)(C)CCC2=O
    InChI
    InChI=1S/C22H29NO7/c1-10-11-4-5-12-20-9-29-22(28,17(27)15(20)19(2,3)7-6-13(20)24)21(12,16(10)26)18(11)30-14(25)8-23/h11-12,15,17-18,27-28H,1,4-9,23H2,2-3H3/t11-,12+,15-,17+,18-,20-,21+,22-/m1/s1
    MOLECULAR FORMULA
    C22H29NO7
    CROSS REFERENCES
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    canSAR841097

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.19
    AlogP 0.09
    HBond donors 4
    HBond acceptors 8
    Atoms 59
    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 canSAR841097.