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canSAR353845
FEATURES
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NAMES
    SMILES
    CC[C@H]1OC(=O)CC(O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@H](CCN2CCCCC2)C[C@@H](C)C(=O)/C=C/[C@]2(C)O[C@H]2[C@@H]1C
    InChI
    InChI=1S/C36H62N2O8/c1-9-30-25(5)34-36(6,46-34)15-13-28(39)22(2)19-26(14-18-38-16-11-10-12-17-38)33(24(4)29(40)21-31(41)44-30)45-35-32(42)27(37(7)8)20-23(3)43-35/h13,15,22-27,29-30,32-35,40,42H,9-12,14,16-21H2,1-8H3/b15-13+/t22-,23-,24+,25-,26+,27+,29?,30-,32-,33-,34+,35+,36+/m1/s1
    MOLECULAR FORMULA
    C36H62N2O8
    CROSS REFERENCES
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    canSAR353845

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 650.45
    AlogP 3.96
    HBond donors 2
    HBond acceptors 10
    Atoms 108
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR353845.