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canSAR1089630
FEATURES
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NAMES
    SMILES
    CC(C)=CCC12OC(C)(C)[C@@H]3C[C@@H](C=C4C(=O)c5c(O)cc6c(c5O[C@]431)C=CC(C)(C)O6)C2=O
    InChI
    InChI=1S/C28H30O6/c1-14(2)7-10-27-24(31)15-11-17-22(30)21-18(29)13-19-16(8-9-25(3,4)32-19)23(21)33-28(17,27)20(12-15)26(5,6)34-27/h7-9,11,13,15,20,29H,10,12H2,1-6H3/t15-,20+,27?,28-/m1/s1
    MOLECULAR FORMULA
    C28H30O6
    CROSS REFERENCES
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    canSAR1089630

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.20
    AlogP 4.94
    HBond donors 1
    HBond acceptors 6
    Atoms 64
    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 canSAR1089630.