canSAR1087334
FEATURES
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NAMES
    SMILES
    C[C@H]1[C@H](O)[C@@H](CO)O[C@@H](O[C@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4C(=O)C=C4[C@@H]6C[C@@](C)(CN[C@@H](CC(=O)O)C(=O)O)CC[C@]6(C)CC[C@]45C)C3(C)C)O[C@H](C(=O)O)[C@@H](O)[C@@H]2O)[C@@H]1O
    InChI
    InChI=1S/C47H73NO16/c1-22-31(53)27(20-49)61-40(32(22)54)64-36-34(56)33(55)35(39(59)60)63-41(36)62-29-10-11-45(6)28(42(29,2)3)9-12-47(8)37(45)26(50)17-23-24-19-43(4,21-48-25(38(57)58)18-30(51)52)13-14-44(24,5)15-16-46(23,47)7/h17,22,24-25,27-29,31-37,40-41,48-49,53-56H,9-16,18-21H2,1-8H3,(H,51,52)(H,57,58)(H,59,60)/t22-,24-,25-,27+,28-,29-,31-,32+,33-,34-,35-,36+,37+,40-,41-,43-,44+,45-,46+,47+/m0/s1
    MOLECULAR FORMULA
    C47H73NO16
    CROSS REFERENCES
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    canSAR1087334
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight907.49
    AlogP2.86
    HBond donors9
    HBond acceptors17
    Atoms137
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087334.