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canSAR1203778
FEATURES
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NAMES
    SMILES
    CCC(=O)C(OC(C)=O)[C@H]1C(C)(C)CCC[C@]1(C)C(=O)CCC1=CCOC1=O
    InChI
    InChI=1S/C22H32O6/c1-6-16(24)18(28-14(2)23)19-21(3,4)11-7-12-22(19,5)17(25)9-8-15-10-13-27-20(15)26/h10,18-19H,6-9,11-13H2,1-5H3/t18?,19-,22+/m0/s1
    MOLECULAR FORMULA
    C22H32O6
    CROSS REFERENCES
    1203778 logo

    canSAR1203778

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 392.22
    AlogP 3.56
    HBond donors 0
    HBond acceptors 6
    Atoms 60
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1203778.