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canSAR841315
FEATURES
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NAMES
    SMILES
    CCCCCOC(=O)C1=CC[C@]23CC[C@H]([C@@]2(OC(C)=O)CC1)[C@@](C)(/C=C/C=C(\C)C(=O)O)OC3=O
    InChI
    InChI=1S/C27H36O8/c1-5-6-7-17-33-23(31)20-10-14-26-15-12-21(27(26,16-11-20)34-19(3)28)25(4,35-24(26)32)13-8-9-18(2)22(29)30/h8-10,13,21H,5-7,11-12,14-17H2,1-4H3,(H,29,30)/b13-8+,18-9+/t21-,25+,26+,27-/m0/s1
    MOLECULAR FORMULA
    C27H36O8
    CROSS REFERENCES
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    canSAR841315

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 488.24
    AlogP 4.43
    HBond donors 1
    HBond acceptors 8
    Atoms 71
    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 canSAR841315.