canSAR817345
FEATURES
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NAMES
    SMILES
    CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](OC(=O)NCCc3ccccc3)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](O)[C@]1(C)O
    InChI
    InChI=1S/C47H81N3O13/c1-15-35-47(10,56)39(52)31(6)50(13)26-27(2)24-45(8,55)40(62-43-37(51)34(49(11)12)23-28(3)58-43)29(4)38(30(5)42(53)60-35)61-36-25-46(9,57-14)41(32(7)59-36)63-44(54)48-22-21-33-19-17-16-18-20-33/h16-20,27-32,34-41,43,51-52,55-56H,15,21-26H2,1-14H3,(H,48,54)/t27-,28-,29+,30-,31-,32+,34+,35-,36+,37-,38+,39-,40-,41+,43+,45+,46-,47-/m1/s1
    MOLECULAR FORMULA
    C47H81N3O13
    CROSS REFERENCES
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    canSAR817345
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight895.58
    AlogP3.88
    HBond donors5
    HBond acceptors16
    Atoms144
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR817345.