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canSAR993021
FEATURES
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NAMES
    SMILES
    C[C@@]12CC[C@@H](O)[C@@](C)(CO)[C@H]1CCC(C=O)=C2CCC1=CCOC1=O
    InChI
    InChI=1S/C20H28O5/c1-19-9-7-17(23)20(2,12-22)16(19)6-4-14(11-21)15(19)5-3-13-8-10-25-18(13)24/h8,11,16-17,22-23H,3-7,9-10,12H2,1-2H3/t16-,17+,19-,20-/m0/s1
    MOLECULAR FORMULA
    C20H28O5
    CROSS REFERENCES
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    canSAR993021

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 348.19
    AlogP 2.31
    HBond donors 2
    HBond acceptors 5
    Atoms 53
    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 canSAR993021.