canSAR1417281
FEATURES
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NAMES
    SMILES
    COc1cc2c(cc1OC)[C@H]1O[C@](CCCCN3C(=O)c4ccccc4C3=O)(C2)Oc2c1c(=O)oc1ccccc21
    InChI
    InChI=1S/C32H27NO8/c1-37-24-15-18-17-32(13-7-8-14-33-29(34)19-9-3-4-10-20(19)30(33)35)40-27-21-11-5-6-12-23(21)39-31(36)26(27)28(41-32)22(18)16-25(24)38-2/h3-6,9-12,15-16,28H,7-8,13-14,17H2,1-2H3/t28?,32-/m1/s1
    MOLECULAR FORMULA
    C32H27NO8
    CROSS REFERENCES
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    canSAR1417281
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight553.17
    AlogP5.03
    HBond donors0
    HBond acceptors9
    Atoms68
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417281.