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canSAR928031
FEATURES
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NAMES
    SMILES
    CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(O)CO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O
    InChI
    InChI=1S/C45H78O24/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-29(48)61-19-24(47)20-62-42-39(58)35(54)31(50)26(67-42)22-64-44-41(60)37(56)33(52)28(69-44)23-65-45-40(59)36(55)32(51)27(68-45)21-63-43-38(57)34(53)30(49)25(18-46)66-43/h6-7,9-10,24-28,30-47,49-60H,2-5,8,11-23H2,1H3/b7-6-,10-9-/t24?,25-,26-,27-,28-,30+,31+,32+,33+,34+,35+,36+,37+,38-,39-,40-,41-,42-,43-,44-,45-/m1/s1
    MOLECULAR FORMULA
    C45H78O24
    CROSS REFERENCES
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    canSAR928031

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 1002.49
    AlogP -4.01
    HBond donors 14
    HBond acceptors 24
    Atoms 147
    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 canSAR928031.