canSAR856389
FEATURES
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NAMES
    SMILES
    C/C1=C/CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)[C@@H](CN(C)[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)[C@@H]2CC1.O=C(O)/C=C/C(=O)O
    InChI
    InChI=1S/C22H35NO8.C4H4O4/c1-11-5-4-8-22(2)19(31-22)18-12(7-6-11)13(20(27)30-18)9-23(3)15-17(26)16(25)14(10-24)29-21(15)28;5-3(6)1-2-4(7)8/h5,12-19,21,24-26,28H,4,6-10H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b11-5-;2-1+/t12-,13-,14+,15+,16+,17+,18-,19-,21+,22+;/m0./s1
    MOLECULAR FORMULA
    C26H39NO12
    CROSS REFERENCES
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    canSAR856389
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight557.25
    AlogP-0.73
    HBond donors6
    HBond acceptors13
    Atoms78
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR856389.