canSAR824441
FEATURES
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NAMES
    SMILES
    COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O[C@@H]5OC[C@H](O)[C@H](O)[C@H]5O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H]5O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
    InChI
    InChI=1S/C54H88O21/c1-24-33(58)42(74-45-39(64)37(62)41(29(22-56)71-45)73-44-38(63)36(61)35(60)28(21-55)70-44)40(65)46(69-24)75-43-34(59)27(57)23-68-47(43)72-32-13-14-51(6)30(50(32,4)5)12-15-53(8)31(51)11-10-25-26-20-49(2,3)16-18-54(26,48(66)67-9)19-17-52(25,53)7/h10,24,26-47,55-65H,11-23H2,1-9H3/t24-,26-,27-,28+,29+,30-,31+,32-,33-,34-,35+,36-,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,47-,51-,52+,53+,54-/m0/s1
    MOLECULAR FORMULA
    C54H88O21
    CROSS REFERENCES
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    canSAR824441
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1072.58
    AlogP0.29
    HBond donors11
    HBond acceptors21
    Atoms163
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824441.