canSAR823801
FEATURES
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NAMES
    SMILES
    CC(=O)O[C@@H]1C=C2/C(=N/O)C[C@H]3[C@@H]4CC(C(C)=O)[C@H]([C@H](C)CCCC(C)C)[C@@]4(C)CC[C@@H]3[C@@]2(C)CC1
    InChI
    InChI=1S/C31H49NO4/c1-18(2)9-8-10-19(3)29-23(20(4)33)16-26-24-17-28(32-35)27-15-22(36-21(5)34)11-13-30(27,6)25(24)12-14-31(26,29)7/h15,18-19,22-26,29,35H,8-14,16-17H2,1-7H3/b32-28+/t19-,22+,23?,24-,25+,26+,29+,30-,31+/m1/s1
    MOLECULAR FORMULA
    C31H49NO4
    CROSS REFERENCES
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    canSAR823801
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight499.37
    AlogP7.21
    HBond donors1
    HBond acceptors5
    Atoms85
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823801.