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canSAR845497
FEATURES
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NAMES
    SMILES
    C=C1CC[C@H]2[C@@](C)(CC[C@@H](O)[C@@]2(C)CO)[C@@H]1C/C=C1/C(=O)OC[C@H]1OC(=O)CCCC(=O)O
    InChI
    InChI=1S/C25H36O8/c1-15-7-10-19-24(2,12-11-20(27)25(19,3)14-26)17(15)9-8-16-18(13-32-23(16)31)33-22(30)6-4-5-21(28)29/h8,17-20,26-27H,1,4-7,9-14H2,2-3H3,(H,28,29)/b16-8+/t17-,18-,19+,20-,24+,25+/m1/s1
    MOLECULAR FORMULA
    C25H36O8
    CROSS REFERENCES
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    canSAR845497

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 464.24
    AlogP 2.77
    HBond donors 3
    HBond acceptors 8
    Atoms 69
    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 canSAR845497.