canSAR633720
FEATURES
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NAMES
    SMILES
    CC12CC(OC(=O)[C@]1(C)O)[C@@H]([C@]1(O)CC[C@H]3[C@@H]4C[C@H]5O[C@]56[C@@H](O)C=CC(=O)[C@]6(C)[C@H]4CC[C@@]31C)C2
    InChI
    InChI=1S/C28H38O7/c1-23-12-17(18(13-23)34-22(31)26(23,4)32)27(33)10-8-15-14-11-21-28(35-21)20(30)6-5-19(29)25(28,3)16(14)7-9-24(15,27)2/h5-6,14-18,20-21,30,32-33H,7-13H2,1-4H3/t14-,15-,16-,17-,18?,20-,21+,23?,24-,25-,26-,27+,28+/m0/s1
    MOLECULAR FORMULA
    C28H38O7
    CROSS REFERENCES
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    canSAR633720
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight486.26
    AlogP2.30
    HBond donors3
    HBond acceptors7
    Atoms73
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR633720.