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canSAR1427473
FEATURES
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NAMES
    SMILES
    C/C(=C\C(=O)OCCCCCCCCC(=O)[O-])C[C@@H]1OC[C@H](C[C@H]2O[C@@H]2[C@@H](C)[C@H](C)O)[C@@H](O)[C@H]1O.C/C(=C\C(=O)OCCCCCCCCC(=O)[O-])C[C@@H]1OC[C@H](C[C@H]2O[C@@H]2[C@@H](C)[C@H](C)O)[C@@H](O)[C@H]1O
    InChI
    InChI=1S/2C26H44O9/c2*1-16(13-23(30)33-11-9-7-5-4-6-8-10-22(28)29)12-20-25(32)24(31)19(15-34-20)14-21-26(35-21)17(2)18(3)27/h2*13,17-21,24-27,31-32H,4-12,14-15H2,1-3H3,(H,28,29)/p-2/b2*16-13+/t2*17-,18-,19-,20-,21+,24+,25-,26+/m00/s1
    MOLECULAR FORMULA
    C52H86O18-2
    CROSS REFERENCES
    1427473 logo

    canSAR1427473

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 998.58
    AlogP 2.52
    HBond donors 6
    HBond acceptors 18
    Atoms 156
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1427473.