data_XVP
#

_chem_comp.id                                   XVP
_chem_comp.name                                 "diethyl ({4-[(2S,3R)-2-[({[(3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl]oxy}carbonyl)amino]-3-hydroxy-4-({[4-(hydroxymethyl)phenyl]sulfonyl}[(2S)-2-methylbutyl]amino)butyl]phenoxy}methyl)phosphonate"
_chem_comp.type                                 non-polymer
_chem_comp.pdbx_type                            HETAIN
_chem_comp.formula                              "C34 H51 N2 O12 P S"
_chem_comp.mon_nstd_parent_comp_id              ?
_chem_comp.pdbx_synonyms                        ?
_chem_comp.pdbx_formal_charge                   0
_chem_comp.pdbx_initial_date                    2021-01-15
_chem_comp.pdbx_modified_date                   2022-01-21
_chem_comp.pdbx_ambiguous_flag                  N
_chem_comp.pdbx_release_status                  REL
_chem_comp.pdbx_replaced_by                     ?
_chem_comp.pdbx_replaces                        ?
_chem_comp.formula_weight                       742.814
_chem_comp.one_letter_code                      ?
_chem_comp.three_letter_code                    XVP
_chem_comp.pdbx_model_coordinates_details       ?
_chem_comp.pdbx_model_coordinates_missing_flag  N
_chem_comp.pdbx_ideal_coordinates_details       Corina
_chem_comp.pdbx_ideal_coordinates_missing_flag  N
_chem_comp.pdbx_model_coordinates_db_code       7LEC
_chem_comp.pdbx_subcomponent_list               ?
_chem_comp.pdbx_processing_site                 RCSB
#   #
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.alt_atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.charge
_chem_comp_atom.pdbx_align
_chem_comp_atom.pdbx_aromatic_flag
_chem_comp_atom.pdbx_leaving_atom_flag
_chem_comp_atom.pdbx_stereo_config
_chem_comp_atom.model_Cartn_x
_chem_comp_atom.model_Cartn_y
_chem_comp_atom.model_Cartn_z
_chem_comp_atom.pdbx_model_Cartn_x_ideal
_chem_comp_atom.pdbx_model_Cartn_y_ideal
_chem_comp_atom.pdbx_model_Cartn_z_ideal
_chem_comp_atom.pdbx_component_atom_id
_chem_comp_atom.pdbx_component_comp_id
_chem_comp_atom.pdbx_ordinal
XVP  C13   C1   C  0  1  N  N  R  20.515  -0.586  15.114    1.617   1.120   1.271  C13   XVP    1  
XVP  C15   C2   C  0  1  N  N  S  20.148  -0.231  16.553    0.369   1.339   0.412  C15   XVP    2  
XVP  C17   C3   C  0  1  N  N  N  22.096   0.275  18.125   -0.285  -1.008   0.476  C17   XVP    3  
XVP  C20   C4   C  0  1  N  N  R  23.753   1.237  19.647   -0.921  -3.296   0.713  C20   XVP    4  
XVP  C21   C5   C  0  1  N  N  N  25.203   1.783  19.099   -2.444  -3.408   0.943  C21   XVP    5  
XVP  C24   C6   C  0  1  N  N  R  24.037   3.507  20.174   -1.906  -5.347  -0.182  C24   XVP    6  
XVP  C26   C7   C  0  1  N  N  N  21.712   3.609  19.926   -0.691  -5.554  -2.187  C26   XVP    7  
XVP  C28   C8   C  0  1  N  N  N  18.804   0.512  16.553   -0.789   1.792   1.303  C28   XVP    8  
XVP  C01   C9   C  0  1  Y  N  N  15.615  -6.175  13.601    7.997   1.274  -1.994  C01   XVP    9  
XVP  C02   C10  C  0  1  Y  N  N  15.347  -4.690  13.801    6.839   2.020  -2.103  C02   XVP   10  
XVP  C03   C11  C  0  1  Y  N  N  16.298  -3.835  14.617    5.956   2.084  -1.041  C03   XVP   11  
XVP  C04   C12  C  0  1  Y  N  N  17.513  -4.529  15.216    6.232   1.401   0.129  C04   XVP   12  
XVP  C05   C13  C  0  1  Y  N  N  17.782  -5.994  15.044    7.391   0.656   0.238  C05   XVP   13  
XVP  C06   C14  C  0  1  Y  N  N  16.828  -6.850  14.215    8.274   0.592  -0.824  C06   XVP   14  
XVP  C11   C15  C  0  1  N  N  N  20.560  -3.986  14.245    4.058  -0.989   1.813  C11   XVP   15  
XVP  C12   C16  C  0  1  N  N  N  19.511  -1.594  14.587    2.776   0.667   0.380  C12   XVP   16  
XVP  C23   C17  C  0  1  N  N  S  23.382   2.130  20.569   -0.549  -4.614   0.007  C23   XVP   17  
XVP  C25   C18  C  0  1  N  N  N  21.903   2.454  20.548   -0.135  -4.307  -1.455  C25   XVP   18  
XVP  C29   C19  C  0  1  Y  N  N  18.532   0.958  18.023   -1.982   2.125   0.444  C29   XVP   19  
XVP  C30   C20  C  0  1  Y  N  N  18.188  -0.131  19.022   -2.148   3.410  -0.039  C30   XVP   20  
XVP  C31   C21  C  0  1  Y  N  N  17.931   0.241  20.489   -3.240   3.718  -0.826  C31   XVP   21  
XVP  C32   C22  C  0  1  Y  N  N  18.003   1.695  20.961   -4.172   2.737  -1.132  C32   XVP   22  
XVP  C33   C23  C  0  1  Y  N  N  18.376   2.779  19.965   -4.004   1.448  -0.646  C33   XVP   23  
XVP  C34   C24  C  0  1  Y  N  N  18.622   2.413  18.484   -2.907   1.144   0.136  C34   XVP   24  
XVP  C36   C25  C  0  1  N  N  N  22.578  -6.205  13.938    4.223  -4.482   0.206  C36   XVP   25  
XVP  C37   C26  C  0  1  N  N  S  22.106  -3.773  14.353    4.206  -2.033   0.705  C37   XVP   26  
XVP  C38   C27  C  0  1  N  N  N  22.736  -4.776  13.378    4.201  -3.434   1.321  C38   XVP   27  
XVP  C39   C28  C  0  1  N  N  N  22.600  -4.050  15.758    5.525  -1.807  -0.036  C39   XVP   28  
XVP  C40   C29  C  0  1  N  N  N  14.642  -7.016  12.749    8.957   1.199  -3.154  C40   XVP   29  
XVP  C41   C30  C  0  1  N  N  N  18.902   2.572  22.956   -6.167   1.977  -2.179  C41   XVP   30  
XVP  C45   C31  C  0  1  N  N  N  21.120   2.933  24.998   -9.207   0.028  -0.075  C45   XVP   31  
XVP  C46   C32  C  0  1  N  N  N  18.431   0.421  26.669   -6.688   0.997   1.850  C46   XVP   32  
XVP  C47   C33  C  0  1  N  N  N  22.010   4.034  24.357  -10.014  -1.121  -0.683  C47   XVP   33  
XVP  C48   C34  C  0  1  N  N  N  17.627  -0.925  26.543   -5.516   0.609   2.755  C48   XVP   34  
XVP  N10   N1   N  0  1  N  N  N  19.839  -2.958  15.086    3.935   0.343   1.215  N10   XVP   35  
XVP  N16   N2   N  0  1  N  N  N  21.125   0.676  17.106    0.010   0.085  -0.256  N16   XVP   36  
XVP  O08   O1   O  0  1  N  N  N  17.823  -2.443  16.757    5.827   1.055   2.630  O08   XVP   37  
XVP  O09   O2   O  0  1  N  N  N  19.216  -4.373  17.235    4.464   2.747   1.395  O09   XVP   38  
XVP  O14   O3   O  0  1  N  N  N  20.291   0.505  14.259    1.967   2.343   1.922  O14   XVP   39  
XVP  O18   O4   O  0  1  N  N  N  22.154  -0.811  18.581   -0.254  -0.953   1.689  O18   XVP   40  
XVP  O19   O5   O  0  1  N  N  N  23.008   1.349  18.452   -0.615  -2.160  -0.138  O19   XVP   41  
XVP  O22   O6   O  0  1  N  N  N  24.983   3.103  18.990   -2.905  -4.309  -0.083  O22   XVP   42  
XVP  O27   O7   O  0  1  N  N  N  23.158   4.320  19.780   -1.915  -5.881  -1.512  O27   XVP   43  
XVP  O35   O8   O  0  1  N  N  N  17.742   1.983  22.358   -5.248   3.037  -1.905  O35   XVP   44  
XVP  O43   O9   O  0  1  N  N  N  19.825   3.418  25.366   -8.208   0.452  -1.005  O43   XVP   45  
XVP  O44   O10  O  0  1  N  N  N  18.825   0.857  25.348   -6.210   1.221   0.522  O44   XVP   46  
XVP  O49   O11  O  0  1  N  N  N  17.232   2.948  25.101   -7.925   2.867  -0.327  O49   XVP   47  
XVP  O50   O12  O  0  1  N  N  N  15.121  -6.946  11.397    9.912   2.257  -3.051  O50   XVP   48  
XVP  P42   P1   P  0  1  N  N  N  18.595   2.455  24.820   -7.173   1.646  -0.696  P42   XVP   49  
XVP  S07   S1   S  0  1  N  N  N  18.642  -3.538  16.208    5.107   1.482   1.483  S07   XVP   50  
XVP  H131  H1   H  0  0  N  N  N  21.541  -0.977  15.053    1.413   0.355   2.020  H131  XVP   51  
XVP  H151  H2   H  0  0  N  N  N  20.069  -1.147  17.157    0.573   2.104  -0.336  H151  XVP   52  
XVP  H201  H3   H  0  0  N  N  N  23.850   0.204  20.011   -0.396  -3.211   1.664  H201  XVP   53  
XVP  H211  H4   H  0  0  N  N  N  25.455   1.338  18.125   -2.648  -3.821   1.931  H211  XVP   54  
XVP  H212  H5   H  0  0  N  N  N  26.008   1.570  19.818   -2.917  -2.432   0.835  H212  XVP   55  
XVP  H241  H6   H  0  0  N  N  N  24.645   3.872  21.015   -2.055  -6.125   0.567  H241  XVP   56  
XVP  H262  H7   H  0  0  N  N  N  21.036   4.247  20.515   -0.876  -5.325  -3.236  H262  XVP   57  
XVP  H261  H8   H  0  0  N  N  N  21.276   3.434  18.931    0.008  -6.386  -2.100  H261  XVP   58  
XVP  H282  H9   H  0  0  N  N  N  18.858   1.392  15.895   -1.052   0.991   1.994  H282  XVP   59  
XVP  H281  H10  H  0  0  N  N  N  18.002  -0.157  16.206   -0.490   2.675   1.867  H281  XVP   60  
XVP  H021  H11  H  0  0  N  N  N  14.471  -4.241  13.357    6.623   2.553  -3.017  H021  XVP   61  
XVP  H031  H12  H  0  0  N  N  N  16.121  -2.780  14.766    5.051   2.667  -1.125  H031  XVP   62  
XVP  H051  H13  H  0  0  N  N  N  18.649  -6.443  15.506    7.607   0.123   1.152  H051  XVP   63  
XVP  H061  H14  H  0  0  N  N  N  17.011  -7.904  14.070    9.179   0.009  -0.739  H061  XVP   64  
XVP  H112  H15  H  0  0  N  N  N  20.250  -3.881  13.195    3.167  -1.207   2.401  H112  XVP   65  
XVP  H111  H16  H  0  0  N  N  N  20.305  -4.994  14.603    4.936  -1.017   2.459  H111  XVP   66  
XVP  H1    H17  H  0  1  N  N  N  19.539  -1.593  13.487    2.476  -0.216  -0.184  H1    XVP   67  
XVP  H2    H18  H  0  1  N  N  N  18.503  -1.315  14.928    3.038   1.468  -0.311  H2    XVP   68  
XVP  H231  H19  H  0  0  N  N  N  23.696   1.854  21.586    0.186  -5.201   0.558  H231  XVP   69  
XVP  H251  H20  H  0  0  N  N  N  21.529   2.527  21.580    0.949  -4.245  -1.551  H251  XVP   70  
XVP  H252  H21  H  0  0  N  N  N  21.361   1.658  20.017   -0.613  -3.395  -1.814  H252  XVP   71  
XVP  H301  H22  H  0  0  N  N  N  18.124  -1.161  18.703   -1.422   4.174   0.199  H301  XVP   72  
XVP  H311  H23  H  0  0  N  N  N  17.695  -0.537  21.200   -3.369   4.722  -1.203  H311  XVP   73  
XVP  H331  H24  H  0  0  N  N  N  18.469   3.804  20.291   -4.728   0.682  -0.883  H331  XVP   74  
XVP  H341  H25  H  0  0  N  N  N  18.859   3.189  17.771   -2.773   0.140   0.511  H341  XVP   75  
XVP  H361  H26  H  0  0  N  N  N  23.029  -6.925  13.240    3.343  -4.359  -0.426  H361  XVP   76  
XVP  H363  H27  H  0  0  N  N  N  23.082  -6.274  14.913    5.123  -4.353  -0.396  H363  XVP   77  
XVP  H362  H28  H  0  0  N  N  N  21.509  -6.434  14.061    4.219  -5.479   0.644  H362  XVP   78  
XVP  H371  H29  H  0  0  N  N  N  22.360  -2.745  14.054    3.375  -1.941   0.005  H371  XVP   79  
XVP  H382  H30  H  0  0  N  N  N  23.805  -4.546  13.255    3.301  -3.563   1.922  H382  XVP   80  
XVP  H381  H31  H  0  0  N  N  N  22.231  -4.706  12.403    5.081  -3.557   1.952  H381  XVP   81  
XVP  H393  H32  H  0  0  N  N  N  22.147  -3.330  16.455    5.493  -0.847  -0.552  H393  XVP   82  
XVP  H391  H33  H  0  0  N  N  N  22.317  -5.072  16.051    6.348  -1.809   0.678  H391  XVP   83  
XVP  H392  H34  H  0  0  N  N  N  23.695  -3.950  15.788    5.674  -2.605  -0.764  H392  XVP   84  
XVP  H402  H35  H  0  0  N  N  N  13.625  -6.602  12.814    9.474   0.240  -3.137  H402  XVP   85  
XVP  H401  H36  H  0  0  N  N  N  14.636  -8.060  13.097    8.405   1.298  -4.089  H401  XVP   86  
XVP  H411  H37  H  0  0  N  N  N  19.808   2.014  22.676   -6.819   2.265  -3.004  H411  XVP   87  
XVP  H412  H38  H  0  0  N  N  N  19.008   3.622  22.646   -5.613   1.078  -2.451  H412  XVP   88  
XVP  H452  H39  H  0  0  N  N  N  20.997   2.114  24.274   -9.873   0.861   0.148  H452  XVP   89  
XVP  H451  H40  H  0  0  N  N  N  21.623   2.553  25.899   -8.728  -0.310   0.844  H451  XVP   90  
XVP  H462  H41  H  0  0  N  N  N  19.327   0.260  27.287   -7.422   0.192   1.842  H462  XVP   91  
XVP  H461  H42  H  0  0  N  N  N  17.796   1.188  27.137   -7.152   1.908   2.228  H461  XVP   92  
XVP  H473  H43  H  0  0  N  N  N  22.990   3.608  24.095  -10.493  -0.783  -1.601  H473  XVP   93  
XVP  H472  H44  H  0  0  N  N  N  21.522   4.417  23.449   -9.348  -1.955  -0.906  H472  XVP   94  
XVP  H471  H45  H  0  0  N  N  N  22.148   4.857  25.074  -10.776  -1.445   0.027  H471  XVP   95  
XVP  H483  H46  H  0  0  N  N  N  17.322  -1.266  27.544   -5.052  -0.302   2.377  H483  XVP   96  
XVP  H481  H47  H  0  0  N  N  N  16.733  -0.761  25.923   -4.782   1.414   2.764  H481  XVP   97  
XVP  H482  H48  H  0  0  N  N  N  18.263  -1.690  26.074   -5.881   0.438   3.768  H482  XVP   98  
XVP  H161  H49  H  0  0  N  N  N  21.139   1.621  16.778   -0.015   0.042  -1.224  H161  XVP   99  
XVP  H141  H50  H  0  0  N  N  N  20.874   1.217  14.494    2.162   3.070   1.315  H141  XVP  100  
XVP  H501  H51  H  0  0  N  N  N  14.550  -7.452  10.832   10.563   2.270  -3.766  H501  XVP  101  
#   #
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
_chem_comp_bond.pdbx_aromatic_flag
_chem_comp_bond.pdbx_stereo_config
_chem_comp_bond.pdbx_ordinal
XVP  O50  C40   SING  N  N    1  
XVP  C40  C01   SING  N  N    2  
XVP  C38  C36   SING  N  N    3  
XVP  C38  C37   SING  N  N    4  
XVP  C01  C02   DOUB  Y  N    5  
XVP  C01  C06   SING  Y  N    6  
XVP  C02  C03   SING  Y  N    7  
XVP  C06  C05   DOUB  Y  N    8  
XVP  C11  C37   SING  N  N    9  
XVP  C11  N10   SING  N  N   10  
XVP  O14  C13   SING  N  N   11  
XVP  C37  C39   SING  N  N   12  
XVP  C12  N10   SING  N  N   13  
XVP  C12  C13   SING  N  N   14  
XVP  C03  C04   DOUB  Y  N   15  
XVP  C05  C04   SING  Y  N   16  
XVP  N10  S07   SING  N  N   17  
XVP  C13  C15   SING  N  N   18  
XVP  C04  S07   SING  N  N   19  
XVP  S07  O08   DOUB  N  N   20  
XVP  S07  O09   DOUB  N  N   21  
XVP  C15  C28   SING  N  N   22  
XVP  C15  N16   SING  N  N   23  
XVP  C28  C29   SING  N  N   24  
XVP  N16  C17   SING  N  N   25  
XVP  C29  C34   DOUB  Y  N   26  
XVP  C29  C30   SING  Y  N   27  
XVP  C17  O19   SING  N  N   28  
XVP  C17  O18   DOUB  N  N   29  
XVP  O19  C20   SING  N  N   30  
XVP  C34  C33   SING  Y  N   31  
XVP  O22  C21   SING  N  N   32  
XVP  O22  C24   SING  N  N   33  
XVP  C30  C31   DOUB  Y  N   34  
XVP  C21  C20   SING  N  N   35  
XVP  C20  C23   SING  N  N   36  
XVP  O27  C26   SING  N  N   37  
XVP  O27  C24   SING  N  N   38  
XVP  C26  C25   SING  N  N   39  
XVP  C33  C32   DOUB  Y  N   40  
XVP  C24  C23   SING  N  N   41  
XVP  C31  C32   SING  Y  N   42  
XVP  C25  C23   SING  N  N   43  
XVP  C32  O35   SING  N  N   44  
XVP  O35  C41   SING  N  N   45  
XVP  C41  P42   SING  N  N   46  
XVP  C47  C45   SING  N  N   47  
XVP  P42  O49   DOUB  N  N   48  
XVP  P42  O44   SING  N  N   49  
XVP  P42  O43   SING  N  N   50  
XVP  C45  O43   SING  N  N   51  
XVP  O44  C46   SING  N  N   52  
XVP  C48  C46   SING  N  N   53  
XVP  C13  H131  SING  N  N   54  
XVP  C15  H151  SING  N  N   55  
XVP  C20  H201  SING  N  N   56  
XVP  C21  H211  SING  N  N   57  
XVP  C21  H212  SING  N  N   58  
XVP  C24  H241  SING  N  N   59  
XVP  C26  H262  SING  N  N   60  
XVP  C26  H261  SING  N  N   61  
XVP  C28  H282  SING  N  N   62  
XVP  C28  H281  SING  N  N   63  
XVP  C02  H021  SING  N  N   64  
XVP  C03  H031  SING  N  N   65  
XVP  C05  H051  SING  N  N   66  
XVP  C06  H061  SING  N  N   67  
XVP  C11  H112  SING  N  N   68  
XVP  C11  H111  SING  N  N   69  
XVP  C12  H1    SING  N  N   70  
XVP  C12  H2    SING  N  N   71  
XVP  C23  H231  SING  N  N   72  
XVP  C25  H251  SING  N  N   73  
XVP  C25  H252  SING  N  N   74  
XVP  C30  H301  SING  N  N   75  
XVP  C31  H311  SING  N  N   76  
XVP  C33  H331  SING  N  N   77  
XVP  C34  H341  SING  N  N   78  
XVP  C36  H361  SING  N  N   79  
XVP  C36  H363  SING  N  N   80  
XVP  C36  H362  SING  N  N   81  
XVP  C37  H371  SING  N  N   82  
XVP  C38  H382  SING  N  N   83  
XVP  C38  H381  SING  N  N   84  
XVP  C39  H393  SING  N  N   85  
XVP  C39  H391  SING  N  N   86  
XVP  C39  H392  SING  N  N   87  
XVP  C40  H402  SING  N  N   88  
XVP  C40  H401  SING  N  N   89  
XVP  C41  H411  SING  N  N   90  
XVP  C41  H412  SING  N  N   91  
XVP  C45  H452  SING  N  N   92  
XVP  C45  H451  SING  N  N   93  
XVP  C46  H462  SING  N  N   94  
XVP  C46  H461  SING  N  N   95  
XVP  C47  H473  SING  N  N   96  
XVP  C47  H472  SING  N  N   97  
XVP  C47  H471  SING  N  N   98  
XVP  C48  H483  SING  N  N   99  
XVP  C48  H481  SING  N  N  100  
XVP  C48  H482  SING  N  N  101  
XVP  N16  H161  SING  N  N  102  
XVP  O14  H141  SING  N  N  103  
XVP  O50  H501  SING  N  N  104  
#   #
loop_
_pdbx_chem_comp_descriptor.comp_id
_pdbx_chem_comp_descriptor.type
_pdbx_chem_comp_descriptor.program
_pdbx_chem_comp_descriptor.program_version
_pdbx_chem_comp_descriptor.descriptor
XVP  SMILES            ACDLabs               12.01  "C(C(Cc1ccc(cc1)OCP(OCC)(OCC)=O)NC(OC2C3C(OC2)OCC3)=O)(CN(CC(C)CC)S(c4ccc(cc4)CO)(=O)=O)O"  
XVP  InChI             InChI                 1.03   "InChI=1S/C34H51N2O12PS/c1-5-24(4)19-36(50(41,42)28-14-10-26(21-37)11-15-28)20-31(38)30(35-34(39)48-32-22-44-33-29(32)16-17-43-33)18-25-8-12-27(13-9-25)45-23-49(40,46-6-2)47-7-3/h8-15,24,29-33,37-38H,5-7,16-23H2,1-4H3,(H,35,39)/t24-,29-,30-,31+,32-,33+/m0/s1"  
XVP  InChIKey          InChI                 1.03   ZDFOHGSCDGSGKK-NRCXORKASA-N  
XVP  SMILES_CANONICAL  CACTVS                3.385  "CCO[P](=O)(COc1ccc(C[C@H](NC(=O)O[C@H]2CO[C@H]3OCC[C@@H]23)[C@H](O)CN(C[C@@H](C)CC)[S](=O)(=O)c4ccc(CO)cc4)cc1)OCC"  
XVP  SMILES            CACTVS                3.385  "CCO[P](=O)(COc1ccc(C[CH](NC(=O)O[CH]2CO[CH]3OCC[CH]23)[CH](O)CN(C[CH](C)CC)[S](=O)(=O)c4ccc(CO)cc4)cc1)OCC"  
XVP  SMILES_CANONICAL  "OpenEye OEToolkits"  2.0.7  "CC[C@H](C)CN(C[C@H]([C@H](Cc1ccc(cc1)OCP(=O)(OCC)OCC)NC(=O)O[C@H]2CO[C@@H]3[C@H]2CCO3)O)S(=O)(=O)c4ccc(cc4)CO"  
XVP  SMILES            "OpenEye OEToolkits"  2.0.7  "CCC(C)CN(CC(C(Cc1ccc(cc1)OCP(=O)(OCC)OCC)NC(=O)OC2COC3C2CCO3)O)S(=O)(=O)c4ccc(cc4)CO"  
#   #
loop_
_pdbx_chem_comp_identifier.comp_id
_pdbx_chem_comp_identifier.type
_pdbx_chem_comp_identifier.program
_pdbx_chem_comp_identifier.program_version
_pdbx_chem_comp_identifier.identifier
XVP  "SYSTEMATIC NAME"  ACDLabs               12.01  "diethyl ({4-[(2S,3R)-2-[({[(3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl]oxy}carbonyl)amino]-3-hydroxy-4-({[4-(hydroxymethyl)phenyl]sulfonyl}[(2S)-2-methylbutyl]amino)butyl]phenoxy}methyl)phosphonate"  
XVP  "SYSTEMATIC NAME"  "OpenEye OEToolkits"  2.0.7  "[(3~{a}~{S},4~{R},6~{a}~{R})-2,3,3~{a},4,5,6~{a}-hexahydrofuro[2,3-b]furan-4-yl] ~{N}-[(2~{S},3~{R})-1-[4-(diethoxyphosphorylmethoxy)phenyl]-4-[[4-(hydroxymethyl)phenyl]sulfonyl-[(2~{S})-2-methylbutyl]amino]-3-oxidanyl-butan-2-yl]carbamate"  
#   #
loop_
_pdbx_chem_comp_audit.comp_id
_pdbx_chem_comp_audit.action_type
_pdbx_chem_comp_audit.date
_pdbx_chem_comp_audit.processing_site
XVP  "Create component"  2021-01-15  RCSB  
XVP  "Initial release"   2022-01-26  RCSB  
##
