canSAR632298
FEATURES
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NAMES
    SMILES
    C[C@H]1CCC/C=C/[C@@H]2C[C@H](OC3OC(CO)C(O)C(O)C3O)C[C@H]2[C@H](O)/C=C/C(=O)O1
    InChI
    InChI=1S/C22H34O9/c1-12-5-3-2-4-6-13-9-14(10-15(13)16(24)7-8-18(25)29-12)30-22-21(28)20(27)19(26)17(11-23)31-22/h4,6-8,12-17,19-24,26-28H,2-3,5,9-11H2,1H3/b6-4+,8-7+/t12-,13+,14-,15+,16+,17?,19?,20?,21?,22?/m0/s1
    MOLECULAR FORMULA
    C22H34O9
    CROSS REFERENCES
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    canSAR632298
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight442.22
    AlogP-0.21
    HBond donors5
    HBond acceptors9
    Atoms65
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR632298.