canSAR862554
FEATURES
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NAMES
    SMILES
    C=C1C[C@@H]2CC[C@@]34C[C@H]5O[C@H]6[C@@H](O3)[C@H]3O[C@H](CC[C@@H]3O[C@H]6[C@H]5O4)CC(=O)C[C@H]3[C@H](C[C@H]4O[C@@H](CC[C@@H]1O2)C[C@@H](C)C4=C)O[C@H](C[C@@H](CN1CCN(C(=O)OCC)CC1)OC)[C@@H]3OC
    InChI
    InChI=1S/C48H72N2O13/c1-7-55-47(52)50-16-14-49(15-17-50)25-33(53-5)22-39-41(54-6)34-21-29(51)20-31-9-11-36-42(58-31)46-45-44(60-36)43-40(61-45)24-48(62-43,63-46)13-12-32-19-27(3)35(56-32)10-8-30-18-26(2)28(4)37(57-30)23-38(34)59-39/h26,30-46H,3-4,7-25H2,1-2,5-6H3/t26-,30+,31-,32+,33+,34+,35+,36+,37-,38+,39-,40-,41-,42+,43+,44+,45-,46+,48+/m1/s1
    MOLECULAR FORMULA
    C48H72N2O13
    CROSS REFERENCES
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    canSAR862554
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight884.50
    AlogP4.91
    HBond donors0
    HBond acceptors15
    Atoms135
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR862554.