canSAR817785
FEATURES
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NAMES
    SMILES
    NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CNC(=O)[C@@H](N)Cc3c[nH]c4ccccc34)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O
    InChI
    InChI=1S/C34H57N9O13/c35-7-17-23(45)25(47)20(40)32(51-17)54-28-14(38)6-13(37)22(44)30(28)56-34-27(49)29(55-33-21(41)26(48)24(46)18(8-36)52-33)19(53-34)10-43-31(50)15(39)5-11-9-42-16-4-2-1-3-12(11)16/h1-4,9,13-15,17-30,32-34,42,44-49H,5-8,10,35-41H2,(H,43,50)/t13-,14+,15+,17-,18+,19-,20-,21-,22+,23-,24-,25-,26-,27-,28-,29-,30-,32-,33-,34+/m1/s1
    MOLECULAR FORMULA
    C34H57N9O13
    CROSS REFERENCES
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    canSAR817785
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight799.41
    AlogP-7.72
    HBond donors22
    HBond acceptors22
    Atoms113
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR817785.