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canSAR1093563
FEATURES
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NAMES
    SMILES
    CC(C)=CCC12OC[C@@H]3[C@@H](CN4CCCC4)[C@@H](C=C4C(=O)c5c(O)cccc5O[C@]431)C2=O
    InChI
    InChI=1S/C26H29NO5/c1-15(2)8-9-25-24(30)16-12-18-23(29)22-20(28)6-5-7-21(22)32-26(18,25)19(14-31-25)17(16)13-27-10-3-4-11-27/h5-8,12,16-17,19,28H,3-4,9-11,13-14H2,1-2H3/t16-,17+,19-,25?,26-/m1/s1
    MOLECULAR FORMULA
    C26H29NO5
    CROSS REFERENCES
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    canSAR1093563

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.20
    AlogP 3.30
    HBond donors 1
    HBond acceptors 6
    Atoms 61
    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 canSAR1093563.