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canSAR1591952
FEATURES
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NAMES
    SMILES
    C[C@@H]1CCC2[C@](C)(CC[C@H](O)[C@@]2(C)CO)[C@@]12CC[C@@](CO)(CC(=O)[O-])O2.[Na+]
    InChI
    InChI=1S/C20H34O6.Na/c1-13-4-5-14-17(2,11-21)15(23)6-7-18(14,3)20(13)9-8-19(12-22,26-20)10-16(24)25;/h13-15,21-23H,4-12H2,1-3H3,(H,24,25);/q;+1/p-1/t13-,14?,15+,17+,18+,19+,20-;/m1./s1
    MOLECULAR FORMULA
    C20H33NaO6
    CROSS REFERENCES
    1591952 logo

    canSAR1591952

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 392.22
    AlogP -2.38
    HBond donors 3
    HBond acceptors 6
    Atoms 60
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1591952.