canSAR292442
FEATURES
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NAMES
    SMILES
    C[C@H](CCCC(C)(C)O)C1CCC2/C(=C/C3OOCC4=C3C[C@@H](O)C[C@@H]4O)CCCC21C
    InChI
    InChI=1S/C27H44O5/c1-17(7-5-11-26(2,3)30)22-9-10-23-18(8-6-12-27(22,23)4)13-25-20-14-19(28)15-24(29)21(20)16-31-32-25/h13,17,19,22-25,28-30H,5-12,14-16H2,1-4H3/b18-13+/t17-,19-,22?,23?,24+,25?,27?/m1/s1
    MOLECULAR FORMULA
    C27H44O5
    CROSS REFERENCES
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    canSAR292442
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight448.32
    AlogP4.85
    HBond donors3
    HBond acceptors5
    Atoms76
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR292442.