canSAR160127
FEATURES
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NAMES
    SMILES
    CC(=O)O[C@H]1[C@@H]2CO[C@@H]2[C@@H]2OCOCCOC(=O)O[C@H]3C(=O)[C@@]2(C)[C@@H]1[C@H](OC(=O)c1ccccc1)[C@]1(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c2ccccc2)c2ccccc2)C(C)=C3C1(C)C
    InChI
    InChI=1S/C49H53NO16/c1-26-32(64-45(56)36(52)35(28-15-9-6-10-16-28)50-43(54)29-17-11-7-12-18-29)23-49(58)41(66-44(55)30-19-13-8-14-20-30)34-37(63-27(2)51)31-24-61-38(31)42-48(34,5)40(53)39(33(26)47(49,3)4)65-46(57)60-22-21-59-25-62-42/h6-20,31-32,34-39,41-42,52,58H,21-25H2,1-5H3,(H,50,54)/t31-,32-,34-,35-,36+,37-,38-,39+,41-,42-,48+,49+/m0/s1
    MOLECULAR FORMULA
    C49H53NO16
    CROSS REFERENCES
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    canSAR160127
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight911.34
    AlogP4.19
    HBond donors3
    HBond acceptors17
    Atoms119
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR160127.