canSAR824478
FEATURES
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NAMES
    SMILES
    CCC(C)C(NC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC(=O)[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(=O)O
    InChI
    InChI=1S/C36H57NO5/c1-10-21(2)27(29(40)41)37-30(42)36-17-15-31(3,4)20-23(36)22-19-24(38)28-33(7)13-12-26(39)32(5,6)25(33)11-14-35(28,9)34(22,8)16-18-36/h19,21,23,25-28,39H,10-18,20H2,1-9H3,(H,37,42)(H,40,41)/t21?,23-,25?,26-,27?,28+,33-,34+,35+,36-/m0/s1
    MOLECULAR FORMULA
    C36H57NO5
    CROSS REFERENCES
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    canSAR824478
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight583.42
    AlogP6.94
    HBond donors3
    HBond acceptors6
    Atoms99
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824478.