canSAR544544
FEATURES
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NAMES
    SMILES
    CC1OC(OC2C(CO)OCCC2OC2OC(O)C(O)C(O[C@@H](CC3CCCCC3)C(=O)[O-])C2O)C(O)C(O)C1O.[Na+]
    InChI
    InChI=1S/C26H44O15.Na/c1-11-16(28)17(29)18(30)25(37-11)40-21-13(7-8-36-15(21)10-27)39-26-20(32)22(19(31)24(35)41-26)38-14(23(33)34)9-12-5-3-2-4-6-12;/h11-22,24-32,35H,2-10H2,1H3,(H,33,34);/q;+1/p-1/t11?,13?,14-,15?,16?,17?,18?,19?,20?,21?,22?,24?,25?,26?;/m0./s1
    MOLECULAR FORMULA
    C26H43NaO15
    CROSS REFERENCES
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    canSAR544544
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight618.25
    AlogP-6.76
    HBond donors7
    HBond acceptors15
    Atoms85
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR544544.