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canSAR846997
FEATURES
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NAMES
    SMILES
    C=C1C(=O)[C@]23C[C@@]1(OC)CC[C@H]2[C@@]12C=CC(=O)[C@](C)(C(=O)O1)[C@H]2[C@@H]3C(=O)OCc1ccccc1
    InChI
    InChI=1S/C27H26O7/c1-15-21(29)26-14-25(15,32-3)11-9-17(26)27-12-10-18(28)24(2,23(31)34-27)20(27)19(26)22(30)33-13-16-7-5-4-6-8-16/h4-8,10,12,17,19-20H,1,9,11,13-14H2,2-3H3/t17-,19-,20-,24+,25+,26-,27-/m1/s1
    MOLECULAR FORMULA
    C27H26O7
    CROSS REFERENCES
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    canSAR846997

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.17
    AlogP 2.73
    HBond donors 0
    HBond acceptors 7
    Atoms 60
    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 canSAR846997.