canSAR737989
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(N)=O
    InChI
    InChI=1S/C37H59N11O18/c1-16(2)13-23(37(66)46-18(3-8-24(39)49)33(62)44-20(6-11-29(56)57)35(64)47-22(31(41)60)14-25(40)50)48-36(65)21(7-12-30(58)59)45-34(63)19(5-10-28(54)55)43-32(61)17(4-9-27(52)53)42-26(51)15-38/h16-23H,3-15,38H2,1-2H3,(H2,39,49)(H2,40,50)(H2,41,60)(H,42,51)(H,43,61)(H,44,62)(H,45,63)(H,46,66)(H,47,64)(H,48,65)(H,52,53)(H,54,55)(H,56,57)(H,58,59)/t17-,18-,19-,20-,21-,22-,23-/m0/s1
    MOLECULAR FORMULA
    C37H59N11O18
    CROSS REFERENCES
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    canSAR737989
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight945.40
    AlogP-6.53
    HBond donors19
    HBond acceptors29
    Atoms125
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR737989.