canSAR824489
FEATURES
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NAMES
    SMILES
    C=C(C)[C@@H]1CC[C@]2(C(=O)NCCCCCCCC(=O)N[C@@H](CC(C)C)[C@H](O)CC(=O)OCc3ccccc3)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12
    InChI
    InChI=1S/C55H86N2O7/c1-36(2)33-42(43(59)34-48(61)63-35-39-19-15-14-16-20-39)57-47(60)21-17-12-11-13-18-32-56-50(62)55-29-24-40(37(3)4)49(55)41-22-23-45-52(8)27-26-46(64-38(5)58)51(6,7)44(52)25-28-54(45,10)53(41,9)30-31-55/h14-16,19-20,36,40-46,49,59H,3,11-13,17-18,21-35H2,1-2,4-10H3,(H,56,62)(H,57,60)/t40-,41+,42-,43+,44-,45+,46-,49+,52-,53+,54+,55-/m0/s1
    MOLECULAR FORMULA
    C55H86N2O7
    CROSS REFERENCES
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    canSAR824489
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight886.64
    AlogP11.06
    HBond donors3
    HBond acceptors9
    Atoms150
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824489.