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canSAR1121611
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCCOc1cccc(/C=C/C(=O)c2cc(C(=O)O)ccc2OCC(=O)O)c1
    InChI
    InChI=1S/C30H38O7/c1-2-3-4-5-6-7-8-9-10-11-19-36-25-14-12-13-23(20-25)15-17-27(31)26-21-24(30(34)35)16-18-28(26)37-22-29(32)33/h12-18,20-21H,2-11,19,22H2,1H3,(H,32,33)(H,34,35)/b17-15+
    MOLECULAR FORMULA
    C30H38O7
    CROSS REFERENCES
    1121611 logo

    canSAR1121611

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 510.26
    AlogP 7.04
    HBond donors 2
    HBond acceptors 7
    Atoms 75
    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 canSAR1121611.