canSAR1846259
FEATURES
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NAMES
    SMILES
    C[C@@]12C[C@H]3OC(=O)[C@H]1CO[C@]14O[C@]5([C@H]2C1=O)[C@@](O)(CC[C@H]1[C@H]4C[C@@H](O)[C@@]2(Cl)CC=CC(=O)[C@]12C)C(=O)O[C@@]35C
    InChI
    InChI=1S/C28H31ClO10/c1-22-10-17-24(3)28-18(22)19(32)27(39-28,36-11-14(22)20(33)37-17)13-9-16(31)25(29)7-4-5-15(30)23(25,2)12(13)6-8-26(28,35)21(34)38-24/h4-5,12-14,16-18,31,35H,6-11H2,1-3H3/t12-,13+,14+,16+,17+,18-,22+,23-,24-,25-,26+,27+,28-/m0/s1
    MOLECULAR FORMULA
    C28H31ClO10
    CROSS REFERENCES
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    canSAR1846259
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight562.16
    AlogP0.97
    HBond donors2
    HBond acceptors10
    Atoms70
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846259.