canSAR1417015
FEATURES
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NAMES
    SMILES
    C=C1CC[C@H](O)C/C1=C/C=C1\CCC[C@]2(C)[C@@H]([C@@](C)(O)CC[C@@H](O)C(C)C)CC[C@@H]12
    InChI
    InChI=1S/C27H44O3/c1-18(2)24(29)14-16-27(5,30)25-13-12-23-20(7-6-15-26(23,25)4)9-10-21-17-22(28)11-8-19(21)3/h9-10,18,22-25,28-30H,3,6-8,11-17H2,1-2,4-5H3/b20-9+,21-10-/t22-,23-,24+,25-,26-,27-/m0/s1
    MOLECULAR FORMULA
    C27H44O3
    CROSS REFERENCES
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    canSAR1417015
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight416.33
    AlogP5.70
    HBond donors3
    HBond acceptors3
    Atoms74
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417015.