canSAR820158
FEATURES
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NAMES
    SMILES
    C[C@@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3CC=C3[C@@H]5CC(C)(C)CC[C@]5(C(=O)O)[C@H](O)C[C@]34C)C2(C)C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H]3O)[C@H](O)[C@H]2O)[C@H]1O
    InChI
    InChI=1S/C59H96O27/c1-23-34(65)46(85-50-42(73)39(70)44(29(21-62)81-50)83-51-43(74)45(37(68)28(20-61)80-51)84-48-40(71)35(66)26(63)22-77-48)47(86-49-41(72)38(69)36(67)27(19-60)79-49)52(78-23)82-33-12-13-56(6)30(55(33,4)5)11-14-57(7)31(56)10-9-24-25-17-54(2,3)15-16-59(25,53(75)76)32(64)18-58(24,57)8/h9,23,25-52,60-74H,10-22H2,1-8H3,(H,75,76)/t23-,25-,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-,56-,57+,58+,59+/m0/s1
    MOLECULAR FORMULA
    C59H96O27
    CROSS REFERENCES
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    canSAR820158
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1236.61
    AlogP-3.01
    HBond donors16
    HBond acceptors27
    Atoms182
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR820158.