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canSAR1633291
FEATURES
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NAMES
    SMILES
    CO[C@H]1[C@H](O[C@H]2C[C@](C)(O)C(=O)c3cc4c(c(O)c32)C(=O)c2c(O)cccc2C4=O)O[C@@H](C)[C@H](O)[C@H]1O
    InChI
    InChI=1S/C26H26O11/c1-9-18(28)22(32)23(35-3)25(36-9)37-14-8-26(2,34)24(33)12-7-11-17(21(31)16(12)14)20(30)15-10(19(11)29)5-4-6-13(15)27/h4-7,9,14,18,22-23,25,27-28,31-32,34H,8H2,1-3H3/t9-,14-,18-,22+,23+,25-,26-/m0/s1
    MOLECULAR FORMULA
    C26H26O11
    CROSS REFERENCES
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    canSAR1633291

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 514.15
    AlogP 0.75
    HBond donors 5
    HBond acceptors 11
    Atoms 63
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1633291.