canSAR823849
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCCCCCCCC(=O)NCCO[C@@H]1[C@@H](C)O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](C)[C@@H](O)[C@H](O)[C@@H]3O)[C@H](O[C@H]3CC[C@@]4(C)C(=CC[C@H]5C6C[C@@H]7O[C@]8(CC[C@H](C)CO8)[C@@H](C)[C@@H]7[C@@]6(C)CC[C@@H]54)C3)O[C@@H]2CO)[C@@H](O)[C@H]1O
    InChI
    InChI=1S/C65H111NO17/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-49(68)66-32-33-75-57-41(5)78-61(55(73)53(57)71)81-58-48(36-67)80-62(59(56(58)74)82-60-54(72)52(70)51(69)40(4)77-60)79-43-27-29-63(6)42(34-43)24-25-44-45(63)28-30-64(7)46(44)35-47-50(64)39(3)65(83-47)31-26-38(2)37-76-65/h24,38-41,43-48,50-62,67,69-74H,8-23,25-37H2,1-7H3,(H,66,68)/t38-,39-,40+,41+,43-,44+,45-,46?,47-,48+,50-,51+,52-,53+,54-,55-,56-,57+,58+,59+,60+,61+,62+,63-,64-,65+/m0/s1
    MOLECULAR FORMULA
    C65H111NO17
    CROSS REFERENCES
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    canSAR823849
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1177.79
    AlogP7.64
    HBond donors8
    HBond acceptors18
    Atoms194
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823849.