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canSAR841056
FEATURES
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NAMES
    SMILES
    C=C[C@@]1(C)CC(=O)[C@@]2(O)[C@H](O1)C(OC(=O)OCC)C(O)[C@H]1C(C)(C)CC[C@H](O)C12C
    InChI
    InChI=1S/C22H34O8/c1-7-20(5)11-13(24)22(27)17(30-20)15(29-18(26)28-8-2)14(25)16-19(3,4)10-9-12(23)21(16,22)6/h7,12,14-17,23,25,27H,1,8-11H2,2-6H3/t12-,14?,15?,16-,17+,20-,21?,22+/m0/s1
    MOLECULAR FORMULA
    C22H34O8
    CROSS REFERENCES
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    canSAR841056

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 426.23
    AlogP 1.74
    HBond donors 3
    HBond acceptors 8
    Atoms 64
    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 canSAR841056.