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canSAR914257
FEATURES
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NAMES
    SMILES
    C=C1/C(=C\C=C2/CCC[C@@]3(C)C2CC[C@@H]3[C@H](C)CCCC(C)(C)O)C[C@@H](O)[C@@H](OCCCO)[C@H]1O
    InChI
    InChI=1S/C30H50O5/c1-20(9-6-15-29(3,4)34)24-13-14-25-22(10-7-16-30(24,25)5)11-12-23-19-26(32)28(27(33)21(23)2)35-18-8-17-31/h11-12,20,24-28,31-34H,2,6-10,13-19H2,1,3-5H3/b22-11+,23-12-/t20-,24-,25?,26-,27+,28-,30-/m1/s1
    MOLECULAR FORMULA
    C30H50O5
    CROSS REFERENCES
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    canSAR914257

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 490.37
    AlogP 5.08
    HBond donors 4
    HBond acceptors 5
    Atoms 85
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR914257.