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canSAR829549
FEATURES
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NAMES
    SMILES
    CCCCCCCc1cc(O)cc(OC(=O)c2c(CCCCCCC)cc(O)cc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1
    InChI
    InChI=1S/C33H48O10/c1-3-5-7-9-11-13-21-15-23(35)18-25(16-21)41-32(40)28-22(14-12-10-8-6-4-2)17-24(36)19-26(28)42-33-31(39)30(38)29(37)27(20-34)43-33/h15-19,27,29-31,33-39H,3-14,20H2,1-2H3/t27-,29+,30+,31-,33-/m1/s1
    MOLECULAR FORMULA
    C33H48O10
    CROSS REFERENCES
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    canSAR829549

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 604.32
    AlogP 4.52
    HBond donors 6
    HBond acceptors 10
    Atoms 91
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR829549.