canSAR2064307
FEATURES
Loading...
NAMES
    SMILES
    CO[C@@H]1C=C2[C@@H]3CC(C)(C)CC[C@]3(CO)[C@H](O)C[C@@]2(C)[C@]2(C)CC[C@@H]3[C@](C)(CC[C@H](O[C@@H]4O[C@H](C)[C@H](O)[C@H](O[C@@H]5O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]5O)[C@H]4O)[C@@]3(C)CO)[C@@H]12
    InChI
    InChI=1S/C45H74O15/c1-22-31(50)36(60-38-34(53)33(52)32(51)27(58-38)19-56-23(2)48)35(54)39(57-22)59-30-11-12-41(5)28(42(30,6)20-46)10-13-43(7)37(41)26(55-9)16-24-25-17-40(3,4)14-15-45(25,21-47)29(49)18-44(24,43)8/h16,22,25-39,46-47,49-54H,10-15,17-21H2,1-9H3/t22-,25+,26-,27-,28-,29-,30+,31+,32-,33+,34-,35-,36+,37-,38+,39+,41+,42+,43-,44-,45-/m1/s1
    MOLECULAR FORMULA
    C45H74O15
    CROSS REFERENCES
    Loading...
    canSAR2064307
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight854.50
    AlogP1.96
    HBond donors8
    HBond acceptors15
    Atoms134
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2064307.