canSAR2096305
FEATURES
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NAMES
    SMILES
    CC(C)=CC[C@H]1C[C@@]23C[C@H]4C(C)(C)c5ccccc5C(=O)[C@]45C(=O)[C@@](CC=C(C)C)(C[C@@]1(C/C=C/C(C)(C)O)[C@@]52O)C3=O
    InChI
    InChI=1S/C38H48O5/c1-23(2)14-15-25-20-36-21-28-33(7,8)27-13-10-9-12-26(27)29(39)37(28)31(41)34(30(36)40,19-16-24(3)4)22-35(25,38(36,37)43)18-11-17-32(5,6)42/h9-14,16-17,25,28,42-43H,15,18-22H2,1-8H3/b17-11+/t25-,28-,34?,35+,36-,37-,38?/m0/s1
    MOLECULAR FORMULA
    C38H48O5
    CROSS REFERENCES
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    canSAR2096305
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight584.35
    AlogP6.86
    HBond donors2
    HBond acceptors5
    Atoms91
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096305.