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canSAR828812
FEATURES
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NAMES
    SMILES
    C=CCN1C[C@H](O)[C@H](OCC23C[C@@H]4[C@H](C)CC[C@H]4C4(C=O)CC2C=C(C(C)C)[C@@]34C(=O)O)O[C@H](C)C1
    InChI
    InChI=1S/C29H43NO6/c1-6-9-30-13-19(5)36-25(24(32)14-30)35-16-28-12-21-18(4)7-8-22(21)27(15-31)11-20(28)10-23(17(2)3)29(27,28)26(33)34/h6,10,15,17-22,24-25,32H,1,7-9,11-14,16H2,2-5H3,(H,33,34)/t18-,19-,20?,21-,22-,24+,25-,27?,28?,29+/m1/s1
    MOLECULAR FORMULA
    C29H43NO6
    CROSS REFERENCES
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    canSAR828812

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 501.31
    AlogP 3.52
    HBond donors 2
    HBond acceptors 7
    Atoms 79
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR828812.