canSAR1002492
FEATURES
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NAMES
    SMILES
    COc1cc2c(O[C@@H]3O[C@@H]4CO[C@@H](C(C)C)O[C@H]4[C@H](O)[C@H]3O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3
    InChI
    InChI=1S/C31H32O12/c1-13(2)30-38-11-22-28(43-30)25(32)26(33)31(41-22)42-27-16-9-20(36-4)19(35-3)8-15(16)23(24-17(27)10-37-29(24)34)14-5-6-18-21(7-14)40-12-39-18/h5-9,13,22,25-26,28,30-33H,10-12H2,1-4H3/t22-,25-,26-,28-,30-,31+/m1/s1
    MOLECULAR FORMULA
    C31H32O12
    CROSS REFERENCES
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    canSAR1002492
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight596.19
    AlogP3.15
    HBond donors2
    HBond acceptors12
    Atoms75
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1002492.