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canSAR1148000
FEATURES
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NAMES
    SMILES
    CC(=O)O[C@H]1CC(=O)OC(C)(C)[C@@H]2C[C@@H](OC(C)=O)[C@]3(C)[C@H]([C@@H](O)[C@H](O)[C@@]4(C)[C@H](c5ccoc5)C[C@H]5O[C@@]534)[C@@]12C
    InChI
    InChI=1S/C30H40O10/c1-14(31)37-19-12-22(33)40-26(3,4)18-11-20(38-15(2)32)29(7)24(27(18,19)5)23(34)25(35)28(6)17(16-8-9-36-13-16)10-21-30(28,29)39-21/h8-9,13,17-21,23-25,34-35H,10-12H2,1-7H3/t17-,18-,19-,20+,21+,23+,24+,25-,27+,28+,29+,30+/m0/s1
    MOLECULAR FORMULA
    C30H40O10
    CROSS REFERENCES
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    canSAR1148000

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 560.26
    AlogP 2.88
    HBond donors 2
    HBond acceptors 10
    Atoms 80
    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 canSAR1148000.