canSAR542925
FEATURES
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NAMES
    SMILES
    CC1OC(OC2CCCCC2OC2OC(C(=O)[O-])C(O)C(O[C@@H](Cc3ccccc3)C(=O)[O-])C2O)C(O)C(O)C1O.[Na+].[Na+]
    InChI
    InChI=1S/C27H38O14.2Na/c1-12-17(28)18(29)19(30)26(37-12)39-14-9-5-6-10-15(14)40-27-21(32)22(20(31)23(41-27)25(35)36)38-16(24(33)34)11-13-7-3-2-4-8-13;;/h2-4,7-8,12,14-23,26-32H,5-6,9-11H2,1H3,(H,33,34)(H,35,36);;/q;2*+1/p-2/t12?,14?,15?,16-,17?,18?,19?,20?,21?,22?,23?,26?,27?;;/m0../s1
    MOLECULAR FORMULA
    C27H36Na2O14
    CROSS REFERENCES
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    canSAR542925
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight630.19
    AlogP-9.89
    HBond donors5
    HBond acceptors14
    Atoms79
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR542925.