canSAR823844
FEATURES
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NAMES
    SMILES
    CO[C@]1(CC[C@H](C)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H]2C[C@H]3[C@@H]4CC=C5C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2[C@@H]1C
    InChI
    InChI=1S/C52H86O22/c1-21(20-66-46-41(62)40(61)36(57)31(18-53)70-46)10-15-52(65-7)22(2)33-30(74-52)17-29-27-9-8-25-16-26(11-13-50(25,5)28(27)12-14-51(29,33)6)69-49-45(73-48-43(64)39(60)35(56)24(4)68-48)44(37(58)32(19-54)71-49)72-47-42(63)38(59)34(55)23(3)67-47/h8,21-24,26-49,53-64H,9-20H2,1-7H3/t21-,22-,23-,24-,26-,27+,28-,29-,30-,31+,32+,33-,34-,35-,36+,37+,38+,39+,40-,41+,42+,43+,44-,45+,46+,47-,48-,49+,50-,51-,52+/m0/s1
    MOLECULAR FORMULA
    C52H86O22
    CROSS REFERENCES
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    canSAR823844
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1062.56
    AlogP-1.33
    HBond donors12
    HBond acceptors22
    Atoms160
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823844.