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canSAR832541
FEATURES
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NAMES
    SMILES
    CC(=O)O[C@@H]1[C@H](O)[C@@H](C)[C@@]23C[C@@H](C[C@H](OC(=O)/C=C/c4ccccc4)[C@]2(C)[C@H]1OC(=O)c1ccccc1)C(C)(C)O3
    InChI
    InChI=1S/C33H38O8/c1-20-27(36)28(38-21(2)34)29(40-30(37)23-14-10-7-11-15-23)32(5)25(18-24-19-33(20,32)41-31(24,3)4)39-26(35)17-16-22-12-8-6-9-13-22/h6-17,20,24-25,27-29,36H,18-19H2,1-5H3/b17-16+/t20-,24-,25+,27-,28-,29+,32-,33+/m1/s1
    MOLECULAR FORMULA
    C33H38O8
    CROSS REFERENCES
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    canSAR832541

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 562.26
    AlogP 4.74
    HBond donors 1
    HBond acceptors 8
    Atoms 79
    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 canSAR832541.