canSAR2098418
FEATURES
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NAMES
    SMILES
    COC(=O)/C(C)=C/COc1cc(=O)oc(/C=C/C=C/C=C/[C@H]2O[C@H]3O[C@H](C)[C@](C)(O)[C@@]3(C)[C@H]2O)c1C
    InChI
    InChI=1S/C27H34O9/c1-16(24(30)32-6)13-14-33-21-15-22(28)35-19(17(21)2)11-9-7-8-10-12-20-23(29)26(4)25(36-20)34-18(3)27(26,5)31/h7-13,15,18,20,23,25,29,31H,14H2,1-6H3/b8-7+,11-9+,12-10+,16-13+/t18-,20-,23+,25-,26+,27+/m1/s1
    MOLECULAR FORMULA
    C27H34O9
    CROSS REFERENCES
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    canSAR2098418
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight502.22
    AlogP2.83
    HBond donors2
    HBond acceptors9
    Atoms70
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2098418.