1616495 logo
canSAR1616495
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC1(C)C[C@H](O)[C@@]23C[C@@H](OC2=O)[C@]2(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]42C)[C@@H]3C1
    InChI
    InChI=1S/C30H46O4/c1-25(2)14-18-17-8-9-20-27(5)12-11-21(31)26(3,4)19(27)10-13-28(20,6)29(17,7)23-16-30(18,22(32)15-25)24(33)34-23/h8,18-23,31-32H,9-16H2,1-7H3/t18-,19?,20?,21-,22-,23+,27-,28+,29-,30-/m0/s1
    MOLECULAR FORMULA
    C30H46O4
    CROSS REFERENCES
    1616495 logo

    canSAR1616495

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 470.34
    AlogP 5.66
    HBond donors 2
    HBond acceptors 4
    Atoms 80
    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 canSAR1616495.