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canSAR840455
FEATURES
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NAMES
    SMILES
    CO[C@H]1O[C@]2(C)CC[C@H]3CCC[C@@H](CCOCc4ccccc4)C13OO2
    InChI
    InChI=1S/C21H30O5/c1-20-13-11-17-9-6-10-18(21(17,26-25-20)19(22-2)24-20)12-14-23-15-16-7-4-3-5-8-16/h3-5,7-8,17-19H,6,9-15H2,1-2H3/t17-,18+,19+,20+,21?/m1/s1
    MOLECULAR FORMULA
    C21H30O5
    CROSS REFERENCES
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    canSAR840455

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 362.21
    AlogP 4.21
    HBond donors 0
    HBond acceptors 5
    Atoms 56
    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 canSAR840455.