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canSAR829625
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NAMES
    SMILES
    CC(=O)O[C@H]1C[C@@]2(C)C3CCC4C(C)(C)/C(=N\O)CC[C@@]45C[C@@]35CC[C@]2(C)C1[C@]1(C)CC[C@H](C(C)(C)OC(C)=O)O1
    InChI
    InChI=1S/C34H53NO6/c1-20(36)39-22-18-31(8)24-11-10-23-28(3,4)25(35-38)12-15-33(23)19-34(24,33)17-16-30(31,7)27(22)32(9)14-13-26(41-32)29(5,6)40-21(2)37/h22-24,26-27,38H,10-19H2,1-9H3/b35-25-/t22-,23?,24?,26+,27?,30+,31-,32-,33+,34-/m0/s1
    MOLECULAR FORMULA
    C34H53NO6
    CROSS REFERENCES
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    canSAR829625

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 571.39
    AlogP 7.08
    HBond donors 1
    HBond acceptors 7
    Atoms 94
    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 canSAR829625.