data_YAV
#

_chem_comp.id                                   YAV
_chem_comp.name                                 "2-[2-[2-[3-[2-[2-[2-[[3-[2-[3-(2-hydroxy-2-oxoethyl)-5-methyl-1-benzofuran-2-yl]ethynyl]phenyl]carbonylamino]ethoxy]ethoxy]ethylcarbamoyl]phenyl]ethynyl]-5-methyl-1-benzofuran-3-yl]ethanoic acid"
_chem_comp.type                                 non-polymer
_chem_comp.pdbx_type                            HETAIN
_chem_comp.formula                              "C46 H40 N2 O10"
_chem_comp.mon_nstd_parent_comp_id              ?
_chem_comp.pdbx_synonyms                        ?
_chem_comp.pdbx_formal_charge                   0
_chem_comp.pdbx_initial_date                    2021-02-15
_chem_comp.pdbx_modified_date                   2022-02-18
_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                       780.817
_chem_comp.one_letter_code                      ?
_chem_comp.three_letter_code                    YAV
_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       7LQP
_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
YAV  C10  C1   C  0  1  N  N  N   0.708  16.473   -5.841  -11.859  -0.804   1.557  C10  YAV   1  
YAV  C15  C2   C  0  1  Y  N  N   2.752  14.066   -4.622  -13.167  -3.774   0.731  C15  YAV   2  
YAV  C17  C3   C  0  1  N  N  N   3.656  12.232   -3.125  -14.759  -5.685   0.692  C17  YAV   3  
YAV  C20  C4   C  0  1  Y  N  N   3.948  14.799   -6.588  -11.130  -3.798  -0.592  C20  YAV   4  
YAV  C22  C5   C  0  1  Y  N  N   0.542  20.285   -9.980   -7.757   2.325   0.676  C22  YAV   5  
YAV  C24  C6   C  0  1  Y  N  N   0.880  21.102  -12.215   -5.709   3.289  -0.106  C24  YAV   6  
YAV  C26  C7   C  0  1  N  N  N   3.222  20.906  -15.985   -2.152   3.023  -2.539  C26  YAV   7  
YAV  C02  C8   C  0  1  N  N  N   2.573  19.983  -13.752   -4.244   2.080  -1.719  C02  YAV   8  
YAV  C03  C9   C  0  1  Y  N  N   1.832  20.116  -12.427   -5.466   2.158  -0.890  C03  YAV   9  
YAV  C04  C10  C  0  1  Y  N  N   2.135  19.222  -11.426   -6.380   1.107  -0.894  C04  YAV  10  
YAV  C05  C11  C  0  1  Y  N  N   1.495  19.307  -10.210   -7.530   1.189  -0.108  C05  YAV  11  
YAV  C06  C12  C  0  1  N  N  N   1.891  18.285   -9.155   -8.475   0.113  -0.105  C06  YAV  12  
YAV  C07  C13  C  0  1  N  N  N   2.246  17.451   -8.400   -9.250  -0.769  -0.102  C07  YAV  13  
YAV  C08  C14  C  0  1  Y  N  N   2.726  16.356   -7.460  -10.195  -1.845  -0.098  C08  YAV  14  
YAV  C09  C15  C  0  1  Y  N  N   2.044  15.946   -6.325  -11.347  -1.873   0.626  C09  YAV  15  
YAV  C11  C16  C  0  1  N  N  N  -0.299  15.384   -6.144  -12.724   0.160   0.787  C11  YAV  16  
YAV  C14  C17  C  0  1  Y  N  N   2.853  14.894   -5.745  -11.986  -3.153   0.320  C14  YAV  17  
YAV  C16  C18  C  0  1  Y  N  N   3.758  13.143   -4.352  -13.488  -5.010   0.244  C16  YAV  18  
YAV  C18  C19  C  0  1  Y  N  N   4.862  13.046   -5.200  -12.650  -5.648  -0.659  C18  YAV  19  
YAV  C19  C20  C  0  1  Y  N  N   4.959  13.870   -6.314  -11.482  -5.049  -1.081  C19  YAV  20  
YAV  C23  C21  C  0  1  Y  N  N   0.236  21.187  -10.988   -6.849   3.364   0.669  C23  YAV  21  
YAV  C27  C22  C  0  1  N  N  N   2.696  21.928  -16.990   -1.330   4.300  -2.356  C27  YAV  22  
YAV  C29  C23  C  0  1  N  N  N   4.656  23.107  -17.487   -0.084   5.543  -0.729  C29  YAV  23  
YAV  C30  C24  C  0  1  N  N  N   5.402  23.625  -18.710    0.354   5.524   0.737  C30  YAV  24  
YAV  C32  C25  C  0  1  N  N  N   4.292  25.485  -19.527    1.701   4.308   2.302  C32  YAV  25  
YAV  C33  C26  C  0  1  N  N  N   3.681  26.063  -20.806    2.626   3.094   2.422  C33  YAV  26  
YAV  C35  C27  C  0  1  N  N  N   3.195  25.511  -23.202    4.786   2.369   1.560  C35  YAV  27  
YAV  C36  C28  C  0  1  Y  N  N   2.849  24.532  -24.325    5.996   2.589   0.739  C36  YAV  28  
YAV  C37  C29  C  0  1  Y  N  N   1.521  24.185  -24.520    6.144   3.773   0.013  C37  YAV  29  
YAV  C38  C30  C  0  1  Y  N  N   1.169  23.306  -25.529    7.273   3.982  -0.755  C38  YAV  30  
YAV  C39  C31  C  0  1  Y  N  N   2.148  22.776  -26.351    8.264   3.023  -0.811  C39  YAV  31  
YAV  C40  C32  C  0  1  Y  N  N   3.474  23.122  -26.161    8.130   1.832  -0.089  C40  YAV  32  
YAV  C41  C33  C  0  1  N  N  N   4.528  22.510  -27.084    9.159   0.837  -0.147  C41  YAV  33  
YAV  C42  C34  C  0  1  N  N  N   5.305  22.026  -27.841   10.002   0.022  -0.195  C42  YAV  34  
YAV  C43  C35  C  0  1  Y  N  N   6.301  21.523  -28.886   11.031  -0.972  -0.254  C43  YAV  35  
YAV  C44  C36  C  0  1  Y  N  N   6.851  22.356  -29.858   11.008  -2.163   0.404  C44  YAV  36  
YAV  C45  C37  C  0  1  N  N  N   6.567  23.843  -30.028    9.919  -2.675   1.312  C45  YAV  37  
YAV  C46  C38  C  0  1  N  N  N   6.267  24.224  -31.472    8.911  -3.448   0.502  C46  YAV  38  
YAV  C49  C39  C  0  1  Y  N  N   7.733  21.513  -30.638   12.253  -2.845   0.051  C49  YAV  39  
YAV  C50  C40  C  0  1  Y  N  N   8.573  21.715  -31.737   12.820  -4.074   0.394  C50  YAV  40  
YAV  C51  C41  C  0  1  Y  N  N   9.306  20.653  -32.255   14.039  -4.424  -0.116  C51  YAV  41  
YAV  C52  C42  C  0  1  N  N  N  10.226  20.873  -33.457   14.653  -5.750   0.252  C52  YAV  42  
YAV  C53  C43  C  0  1  Y  N  N   9.201  19.388  -31.675   14.714  -3.566  -0.972  C53  YAV  43  
YAV  C54  C44  C  0  1  Y  N  N   8.366  19.185  -30.584   14.171  -2.348  -1.323  C54  YAV  44  
YAV  C55  C45  C  0  1  Y  N  N   7.626  20.255  -30.059   12.934  -1.971  -0.817  C55  YAV  45  
YAV  C57  C46  C  0  1  Y  N  N   3.830  24.004  -25.152    6.994   1.618   0.692  C57  YAV  46  
YAV  N25  N1   N  0  1  N  N  N   2.507  21.045  -14.732   -3.363   3.100  -1.718  N25  YAV  47  
YAV  N34  N2   N  0  1  N  N  N   3.373  25.065  -21.822    3.824   3.312   1.608  N34  YAV  48  
YAV  O01  O1   O  0  1  N  N  N   3.211  19.011  -13.972   -4.034   1.097  -2.401  O01  YAV  49  
YAV  O12  O2   O  0  1  N  N  N  -0.262  14.335   -5.455  -13.293   1.201   1.415  O12  YAV  50  
YAV  O13  O3   O  0  1  N  N  N  -1.140  15.517   -7.069  -12.907  -0.005  -0.396  O13  YAV  51  
YAV  O21  O4   O  0  1  Y  N  N   3.826  15.676   -7.576  -10.079  -2.983  -0.813  O21  YAV  52  
YAV  O28  O5   O  0  1  N  N  N   3.717  22.162  -17.919   -0.867   4.381  -1.007  O28  YAV  53  
YAV  O31  O6   O  0  1  N  N  N   4.475  24.105  -19.644    1.231   4.417   0.957  O31  YAV  54  
YAV  O47  O7   O  0  1  N  N  N   6.814  25.239  -31.978    7.847  -4.001   1.105  O47  YAV  55  
YAV  O48  O8   O  0  1  N  N  N   5.474  23.520  -32.148    9.061  -3.570  -0.691  O48  YAV  56  
YAV  O56  O9   O  0  1  Y  N  N   6.774  20.319  -29.042   12.167  -0.873  -0.974  O56  YAV  57  
YAV  O58  O10  O  0  1  N  N  N   3.306  26.662  -23.456    4.659   1.338   2.191  O58  YAV  58  
YAV  H1   H1   H  0  1  N  N  N   0.744  16.672   -4.760  -12.446  -1.265   2.351  H1   YAV  59  
YAV  H2   H2   H  0  1  N  N  N   0.445  17.398   -6.375  -11.016  -0.267   1.992  H2   YAV  60  
YAV  H3   H3   H  0  1  N  N  N   1.897  14.143   -3.967  -13.822  -3.281   1.434  H3   YAV  61  
YAV  H4   H4   H  0  1  N  N  N   4.130  12.723   -2.263  -15.572  -5.409   0.020  H4   YAV  62  
YAV  H5   H5   H  0  1  N  N  N   2.597  12.038   -2.900  -14.623  -6.766   0.673  H5   YAV  63  
YAV  H6   H6   H  0  1  N  N  N   4.167  11.280   -3.332  -15.002  -5.367   1.706  H6   YAV  64  
YAV  H7   H7   H  0  1  N  N  N   0.042  20.345   -9.025   -8.647   2.391   1.285  H7   YAV  65  
YAV  H8   H8   H  0  1  N  N  N   0.640  21.802  -13.002   -5.003   4.106  -0.106  H8   YAV  66  
YAV  H9   H9   H  0  1  N  N  N   3.072  19.891  -16.382   -2.430   2.916  -3.587  H9   YAV  67  
YAV  H10  H10  H  0  1  N  N  N   4.295  21.078  -15.815   -1.558   2.162  -2.231  H10  YAV  68  
YAV  H11  H11  H  0  1  N  N  N   2.875  18.454  -11.594   -6.199   0.233  -1.502  H11  YAV  69  
YAV  H12  H12  H  0  1  N  N  N   5.642  12.329   -4.990  -12.916  -6.625  -1.036  H12  YAV  70  
YAV  H13  H13  H  0  1  N  N  N   5.814  13.794   -6.969  -10.836  -5.558  -1.782  H13  YAV  71  
YAV  H14  H14  H  0  1  N  N  N  -0.503  21.956  -10.818   -7.031   4.241   1.274  H14  YAV  72  
YAV  H15  H15  H  0  1  N  N  N   2.435  22.864  -16.474   -0.475   4.282  -3.033  H15  YAV  73  
YAV  H16  H16  H  0  1  N  N  N   1.806  21.530  -17.501   -1.951   5.167  -2.580  H16  YAV  74  
YAV  H17  H17  H  0  1  N  N  N   5.365  22.637  -16.789   -0.680   6.436  -0.918  H17  YAV  75  
YAV  H18  H18  H  0  1  N  N  N   4.143  23.939  -16.983    0.796   5.551  -1.372  H18  YAV  76  
YAV  H19  H19  H  0  1  N  N  N   5.987  22.808  -19.158    0.875   6.453   0.972  H19  YAV  77  
YAV  H20  H20  H  0  1  N  N  N   6.079  24.439  -18.411   -0.522   5.427   1.377  H20  YAV  78  
YAV  H21  H21  H  0  1  N  N  N   5.265  25.964  -19.344    0.852   4.185   2.975  H21  YAV  79  
YAV  H22  H22  H  0  1  N  N  N   3.619  25.689  -18.682    2.250   5.210   2.570  H22  YAV  80  
YAV  H23  H23  H  0  1  N  N  N   4.393  26.783  -21.234    2.914   2.958   3.464  H23  YAV  81  
YAV  H24  H24  H  0  1  N  N  N   2.749  26.583  -20.539    2.104   2.204   2.070  H24  YAV  82  
YAV  H25  H25  H  0  1  N  N  N   0.757  24.603  -23.881    5.373   4.529   0.052  H25  YAV  83  
YAV  H26  H26  H  0  1  N  N  N   0.134  23.035  -25.675    7.381   4.899  -1.314  H26  YAV  84  
YAV  H27  H27  H  0  1  N  N  N   1.877  22.092  -27.141    9.142   3.190  -1.416  H27  YAV  85  
YAV  H28  H28  H  0  1  N  N  N   7.447  24.410  -29.690   10.355  -3.328   2.069  H28  YAV  86  
YAV  H29  H29  H  0  1  N  N  N   5.699  24.109  -29.407    9.426  -1.834   1.799  H29  YAV  87  
YAV  H30  H30  H  0  1  N  N  N   8.653  22.695  -32.183   12.298  -4.745   1.061  H30  YAV  88  
YAV  H31  H31  H  0  1  N  N  N  11.229  21.154  -33.105   14.337  -6.508  -0.464  H31  YAV  89  
YAV  H32  H32  H  0  1  N  N  N  10.290  19.945  -34.044   15.739  -5.665   0.236  H32  YAV  90  
YAV  H33  H33  H  0  1  N  N  N   9.820  21.678  -34.087   14.325  -6.036   1.252  H33  YAV  91  
YAV  H34  H34  H  0  1  N  N  N   9.772  18.563  -32.076   15.677  -3.855  -1.368  H34  YAV  92  
YAV  H35  H35  H  0  1  N  N  N   8.286  18.204  -30.140   14.705  -1.689  -1.990  H35  YAV  93  
YAV  H36  H36  H  0  1  N  N  N   4.865  24.278  -25.011    6.885   0.701   1.252  H36  YAV  94  
YAV  H37  H37  H  0  1  N  N  N   1.972  21.869  -14.546   -3.530   3.885  -1.173  H37  YAV  95  
YAV  H38  H38  H  0  1  N  N  N   3.286  24.098  -21.581    3.926   4.135   1.105  H38  YAV  96  
YAV  H39  H39  H  0  1  N  N  N  -0.934  13.735   -5.755  -13.840   1.791   0.879  H39  YAV  97  
YAV  H40  H40  H  0  1  N  N  N   6.526  25.339  -32.878    7.227  -4.487   0.543  H40  YAV  98  
#   #
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
YAV  C52  C51  SING  N  N    1  
YAV  C51  C50  DOUB  Y  N    2  
YAV  C51  C53  SING  Y  N    3  
YAV  O48  C46  DOUB  N  N    4  
YAV  O47  C46  SING  N  N    5  
YAV  C50  C49  SING  Y  N    6  
YAV  C53  C54  DOUB  Y  N    7  
YAV  C46  C45  SING  N  N    8  
YAV  C49  C55  DOUB  Y  N    9  
YAV  C49  C44  SING  Y  N   10  
YAV  C54  C55  SING  Y  N   11  
YAV  C55  O56  SING  Y  N   12  
YAV  C45  C44  SING  N  N   13  
YAV  C44  C43  DOUB  Y  N   14  
YAV  O56  C43  SING  Y  N   15  
YAV  C43  C42  SING  N  N   16  
YAV  C42  C41  TRIP  N  N   17  
YAV  C41  C40  SING  N  N   18  
YAV  C39  C40  DOUB  Y  N   19  
YAV  C39  C38  SING  Y  N   20  
YAV  C40  C57  SING  Y  N   21  
YAV  C38  C37  DOUB  Y  N   22  
YAV  C57  C36  DOUB  Y  N   23  
YAV  C37  C36  SING  Y  N   24  
YAV  C36  C35  SING  N  N   25  
YAV  O58  C35  DOUB  N  N   26  
YAV  C35  N34  SING  N  N   27  
YAV  N34  C33  SING  N  N   28  
YAV  C33  C32  SING  N  N   29  
YAV  O31  C32  SING  N  N   30  
YAV  O31  C30  SING  N  N   31  
YAV  C30  C29  SING  N  N   32  
YAV  O28  C29  SING  N  N   33  
YAV  O28  C27  SING  N  N   34  
YAV  C27  C26  SING  N  N   35  
YAV  C26  N25  SING  N  N   36  
YAV  N25  C02  SING  N  N   37  
YAV  O01  C02  DOUB  N  N   38  
YAV  C02  C03  SING  N  N   39  
YAV  C03  C24  DOUB  Y  N   40  
YAV  C03  C04  SING  Y  N   41  
YAV  C24  C23  SING  Y  N   42  
YAV  C04  C05  DOUB  Y  N   43  
YAV  C23  C22  DOUB  Y  N   44  
YAV  C05  C22  SING  Y  N   45  
YAV  C05  C06  SING  N  N   46  
YAV  C06  C07  TRIP  N  N   47  
YAV  C07  C08  SING  N  N   48  
YAV  O21  C08  SING  Y  N   49  
YAV  O21  C20  SING  Y  N   50  
YAV  C08  C09  DOUB  Y  N   51  
YAV  O13  C11  DOUB  N  N   52  
YAV  C20  C19  DOUB  Y  N   53  
YAV  C20  C14  SING  Y  N   54  
YAV  C09  C10  SING  N  N   55  
YAV  C09  C14  SING  Y  N   56  
YAV  C19  C18  SING  Y  N   57  
YAV  C11  C10  SING  N  N   58  
YAV  C11  O12  SING  N  N   59  
YAV  C14  C15  DOUB  Y  N   60  
YAV  C18  C16  DOUB  Y  N   61  
YAV  C15  C16  SING  Y  N   62  
YAV  C16  C17  SING  N  N   63  
YAV  C10  H1   SING  N  N   64  
YAV  C10  H2   SING  N  N   65  
YAV  C15  H3   SING  N  N   66  
YAV  C17  H4   SING  N  N   67  
YAV  C17  H5   SING  N  N   68  
YAV  C17  H6   SING  N  N   69  
YAV  C22  H7   SING  N  N   70  
YAV  C24  H8   SING  N  N   71  
YAV  C26  H9   SING  N  N   72  
YAV  C26  H10  SING  N  N   73  
YAV  C04  H11  SING  N  N   74  
YAV  C18  H12  SING  N  N   75  
YAV  C19  H13  SING  N  N   76  
YAV  C23  H14  SING  N  N   77  
YAV  C27  H15  SING  N  N   78  
YAV  C27  H16  SING  N  N   79  
YAV  C29  H17  SING  N  N   80  
YAV  C29  H18  SING  N  N   81  
YAV  C30  H19  SING  N  N   82  
YAV  C30  H20  SING  N  N   83  
YAV  C32  H21  SING  N  N   84  
YAV  C32  H22  SING  N  N   85  
YAV  C33  H23  SING  N  N   86  
YAV  C33  H24  SING  N  N   87  
YAV  C37  H25  SING  N  N   88  
YAV  C38  H26  SING  N  N   89  
YAV  C39  H27  SING  N  N   90  
YAV  C45  H28  SING  N  N   91  
YAV  C45  H29  SING  N  N   92  
YAV  C50  H30  SING  N  N   93  
YAV  C52  H31  SING  N  N   94  
YAV  C52  H32  SING  N  N   95  
YAV  C52  H33  SING  N  N   96  
YAV  C53  H34  SING  N  N   97  
YAV  C54  H35  SING  N  N   98  
YAV  C57  H36  SING  N  N   99  
YAV  N25  H37  SING  N  N  100  
YAV  N34  H38  SING  N  N  101  
YAV  O12  H39  SING  N  N  102  
YAV  O47  H40  SING  N  N  103  
#   #
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
YAV  InChI             InChI                 1.03   "InChI=1S/C46H40N2O10/c1-29-9-13-39-35(23-29)37(27-43(49)50)41(57-39)15-11-31-5-3-7-33(25-31)45(53)47-17-19-55-21-22-56-20-18-48-46(54)34-8-4-6-32(26-34)12-16-42-38(28-44(51)52)36-24-30(2)10-14-40(36)58-42/h3-10,13-14,23-26H,17-22,27-28H2,1-2H3,(H,47,53)(H,48,54)(H,49,50)(H,51,52)"  
YAV  InChIKey          InChI                 1.03   CNJSVQQGSQPFLB-UHFFFAOYSA-N  
YAV  SMILES_CANONICAL  CACTVS                3.385  "Cc1ccc2oc(C#Cc3cccc(c3)C(=O)NCCOCCOCCNC(=O)c4cccc(c4)C#Cc5oc6ccc(C)cc6c5CC(O)=O)c(CC(O)=O)c2c1"  
YAV  SMILES            CACTVS                3.385  "Cc1ccc2oc(C#Cc3cccc(c3)C(=O)NCCOCCOCCNC(=O)c4cccc(c4)C#Cc5oc6ccc(C)cc6c5CC(O)=O)c(CC(O)=O)c2c1"  
YAV  SMILES_CANONICAL  "OpenEye OEToolkits"  2.0.7  "Cc1ccc2c(c1)c(c(o2)C#Cc3cccc(c3)C(=O)NCCOCCOCCNC(=O)c4cccc(c4)C#Cc5c(c6cc(ccc6o5)C)CC(=O)O)CC(=O)O"  
YAV  SMILES            "OpenEye OEToolkits"  2.0.7  "Cc1ccc2c(c1)c(c(o2)C#Cc3cccc(c3)C(=O)NCCOCCOCCNC(=O)c4cccc(c4)C#Cc5c(c6cc(ccc6o5)C)CC(=O)O)CC(=O)O"  
#
_pdbx_chem_comp_identifier.comp_id          YAV
_pdbx_chem_comp_identifier.type             "SYSTEMATIC NAME"
_pdbx_chem_comp_identifier.program          "OpenEye OEToolkits"
_pdbx_chem_comp_identifier.program_version  2.0.7
_pdbx_chem_comp_identifier.identifier       "2-[2-[2-[3-[2-[2-[2-[[3-[2-[3-(2-hydroxy-2-oxoethyl)-5-methyl-1-benzofuran-2-yl]ethynyl]phenyl]carbonylamino]ethoxy]ethoxy]ethylcarbamoyl]phenyl]ethynyl]-5-methyl-1-benzofuran-3-yl]ethanoic acid"
#   #
loop_
_pdbx_chem_comp_audit.comp_id
_pdbx_chem_comp_audit.action_type
_pdbx_chem_comp_audit.date
_pdbx_chem_comp_audit.processing_site
YAV  "Create component"  2021-02-15  RCSB  
YAV  "Initial release"   2022-02-23  RCSB  
##
