data_V8P
#

_chem_comp.id                                   V8P
_chem_comp.name                                 "(3R)-N-[(2S,3R)-1-(alpha-D-galactopyranosyloxy)-3-hydroxyheptadecan-2-yl]-3-hydroxyheptadecanamide"
_chem_comp.type                                 non-polymer
_chem_comp.pdbx_type                            HETAIN
_chem_comp.formula                              "C40 H79 N O9"
_chem_comp.mon_nstd_parent_comp_id              ?
_chem_comp.pdbx_synonyms                        ?
_chem_comp.pdbx_formal_charge                   0
_chem_comp.pdbx_initial_date                    2020-07-17
_chem_comp.pdbx_modified_date                   2021-11-05
_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                       718.057
_chem_comp.one_letter_code                      ?
_chem_comp.three_letter_code                    V8P
_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       6XNG
_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
V8P  C21  C1   C  0  1  N  N  N   4.287  29.098  72.786   13.661   -9.690   0.835  C21  V8P    1  
V8P  C16  C2   C  0  1  N  N  N  12.324  40.797  77.306  -13.469   -4.665  -0.070  C16  V8P    2  
V8P  C20  C3   C  0  1  N  N  N   5.337  28.006  73.027   13.407   -8.186   0.956  C20  V8P    3  
V8P  C15  C4   C  0  1  N  N  N  11.987  41.970  78.226  -14.377   -5.489   0.847  C15  V8P    4  
V8P  C17  C5   C  0  1  N  N  N  12.656  43.254  77.728  -15.674   -5.827   0.110  C17  V8P    5  
V8P  C14  C6   C  0  1  N  N  N   6.494  28.549  73.880   12.000   -7.864   0.448  C14  V8P    6  
V8P  C19  C7   C  0  1  N  N  N  13.230  44.992  79.438  -17.878   -6.990   0.290  C19  V8P    7  
V8P  C13  C8   C  0  1  N  N  N   7.776  28.566  73.038   11.746   -6.360   0.569  C13  V8P    8  
V8P  C9   C9   C  0  1  N  N  N   9.718  33.108  72.316    8.424   -2.708  -0.206  C9   V8P    9  
V8P  C11  C10  C  0  1  N  N  N   8.593  30.875  72.411   10.085   -4.534   0.182  C11  V8P   10  
V8P  C8   C11  C  0  1  N  N  N  10.427  33.802  71.144    7.018   -2.386  -0.714  C8   V8P   11  
V8P  C7   C12  C  0  1  N  N  N   9.410  34.587  70.310    6.764   -0.882  -0.593  C7   V8P   12  
V8P  C5   C13  C  0  1  N  N  N   9.123  36.265  68.468    5.103    0.944  -0.980  C5   V8P   13  
V8P  C6   C14  C  0  1  N  N  N  10.126  35.638  69.455    5.357   -0.560  -1.102  C6   V8P   14  
V8P  C4   C15  C  0  1  N  N  N   9.419  37.766  68.307    3.696    1.266  -1.489  C4   V8P   15  
V8P  C1   C16  C  0  1  N  N  N   9.084  40.345  65.375    1.755    4.585  -1.686  C1   V8P   16  
V8P  C3   C17  C  0  1  N  N  R   9.118  38.267  66.880    3.442    2.770  -1.368  C3   V8P   17  
V8P  C2   C18  C  0  1  N  N  S   9.628  39.723  66.684    1.995    3.076  -1.758  C2   V8P   18  
V8P  OAA  O1   O  0  1  N  N  N  11.408  41.941  67.337   -0.539    2.368  -2.347  OAA  V8P   19  
V8P  CAA  C19  C  0  1  N  N  N  11.851  40.837  67.016   -0.166    2.081  -1.229  CAA  V8P   20  
V8P  CAB  C20  C  0  1  N  N  N  13.356  40.586  66.931   -1.101    1.378  -0.280  CAB  V8P   21  
V8P  CAC  C21  C  0  1  N  N  R  14.047  41.022  68.230   -2.447    1.145  -0.970  CAC  V8P   22  
V8P  O4   O2   O  0  1  N  N  N  15.357  41.497  67.903   -3.065    2.404  -1.246  O4   V8P   23  
V8P  CAD  C22  C  0  1  N  N  N  14.118  39.844  69.214   -3.354    0.322  -0.053  CAD  V8P   24  
V8P  CAE  C23  C  0  1  N  N  N  14.965  40.190  70.454   -4.652   -0.017  -0.790  CAE  V8P   25  
V8P  CAF  C24  C  0  1  N  N  N  14.198  39.857  71.739   -5.559   -0.840   0.127  CAF  V8P   26  
V8P  CAG  C25  C  0  1  N  N  N  14.650  38.508  72.315   -6.856   -1.179  -0.610  CAG  V8P   27  
V8P  CAH  C26  C  0  1  N  N  N  15.247  38.728  73.708   -7.763   -2.002   0.307  CAH  V8P   28  
V8P  CAI  C27  C  0  1  N  N  N  14.295  38.192  74.779   -9.061   -2.341  -0.430  CAI  V8P   29  
V8P  CAJ  C28  C  0  1  N  N  N  14.658  38.842  76.111   -9.968   -3.164   0.487  CAJ  V8P   30  
V8P  CAK  C29  C  0  1  N  N  N  13.541  38.604  77.135  -11.265   -3.503  -0.250  CAK  V8P   31  
V8P  CAL  C30  C  0  1  N  N  N  13.332  39.861  77.989  -12.172   -4.326   0.667  CAL  V8P   32  
V8P  N2   N1   N  0  1  N  N  N  11.107  39.766  66.679    1.085    2.392  -0.836  N2   V8P   33  
V8P  O1A  O3   O  0  1  N  N  N   9.813  39.833  64.256    2.095    5.059  -0.381  O1A  V8P   34  
V8P  C1A  C31  C  0  1  N  N  S   9.514  40.487  63.022    1.906    6.465  -0.206  C1A  V8P   35  
V8P  C2A  C32  C  0  1  N  N  R  10.057  39.655  61.861    2.527    6.902   1.124  C2A  V8P   36  
V8P  O2A  O4   O  0  1  N  N  N   9.584  38.300  61.947    3.913    6.554   1.140  O2A  V8P   37  
V8P  C3A  C33  C  0  1  N  N  S  11.594  39.677  61.876    1.807    6.189   2.273  C3A  V8P   38  
V8P  O3A  O5   O  0  1  N  N  N  12.089  38.884  60.802    2.332    6.645   3.521  O3A  V8P   39  
V8P  C4A  C34  C  0  1  N  N  R  12.146  41.112  61.796    0.310    6.507   2.198  C4A  V8P   40  
V8P  O4A  O6   O  0  1  N  N  N  11.852  41.690  60.495    0.110    7.910   2.378  O4A  V8P   41  
V8P  C5M  C35  C  0  1  N  N  R  11.532  41.952  62.944   -0.225    6.085   0.827  C5M  V8P   42  
V8P  C6A  C36  C  0  1  N  N  N  11.931  43.431  62.851   -1.706    6.454   0.722  C6A  V8P   43  
V8P  O6A  O7   O  0  1  N  N  N  13.231  43.601  63.415   -2.234    5.957  -0.509  O6A  V8P   44  
V8P  O5A  O8   O  0  1  N  N  N  10.074  41.831  62.955    0.508    6.760  -0.197  O5A  V8P   45  
V8P  O3   O9   O  0  1  N  N  N   7.700  38.213  66.672    4.330    3.475  -2.239  O3   V8P   46  
V8P  C10  C37  C  0  1  N  N  N   9.948  31.588  72.293    8.679   -4.212  -0.327  C10  V8P   47  
V8P  C12  C38  C  0  1  N  N  N   8.672  29.747  73.443   10.339   -6.038   0.060  C12  V8P   48  
V8P  C18  C39  C  0  1  N  N  N  13.696  43.703  78.753  -16.581   -6.651   1.027  C18  V8P   49  
V8P  C22  C40  C  0  1  N  N  N   2.969  28.709  73.451   15.067  -10.012   1.344  C22  V8P   50  
V8P  H1   H1   H  0  1  N  N  N   4.644  30.047  73.212   12.926  -10.232   1.431  H1   V8P   51  
V8P  H2   H2   H  0  1  N  N  N   4.128  29.218  71.704   13.574   -9.990  -0.209  H2   V8P   52  
V8P  H3   H3   H  0  1  N  N  N  12.760  41.181  76.372  -13.239   -5.242  -0.966  H3   V8P   53  
V8P  H4   H4   H  0  1  N  N  N  11.405  40.237  77.079  -13.978   -3.744  -0.352  H4   V8P   54  
V8P  H5   H5   H  0  1  N  N  N   4.867  27.161  73.551   13.493   -7.886   2.000  H5   V8P   55  
V8P  H6   H6   H  0  1  N  N  N   5.731  27.663  72.059   14.141   -7.644   0.360  H6   V8P   56  
V8P  H7   H7   H  0  1  N  N  N  10.897  42.114  78.244  -13.868   -6.410   1.129  H7   V8P   57  
V8P  H8   H8   H  0  1  N  N  N  12.344  41.747  79.242  -14.608   -4.912   1.742  H8   V8P   58  
V8P  H9   H9   H  0  1  N  N  N  13.148  43.063  76.763  -16.183   -4.906  -0.172  H9   V8P   59  
V8P  H10  H10  H  0  1  N  N  N  11.897  44.041  77.604  -15.443   -6.404  -0.786  H10  V8P   60  
V8P  H11  H11  H  0  1  N  N  N   6.258  29.571  74.212   11.913   -8.164  -0.596  H11  V8P   61  
V8P  H12  H12  H  0  1  N  N  N   6.639  27.902  74.758   11.265   -8.406   1.044  H12  V8P   62  
V8P  H13  H13  H  0  1  N  N  N  13.983  45.309  80.174  -17.648   -7.566  -0.606  H13  V8P   63  
V8P  H14  H14  H  0  1  N  N  N  13.100  45.782  78.683  -18.525   -7.576   0.943  H14  V8P   64  
V8P  H15  H15  H  0  1  N  N  N  12.272  44.811  79.948  -18.387   -6.068   0.008  H15  V8P   65  
V8P  H16  H16  H  0  1  N  N  N   7.509  28.662  71.975   11.833   -6.060   1.613  H16  V8P   66  
V8P  H17  H17  H  0  1  N  N  N   8.324  27.625  73.195   12.481   -5.818  -0.027  H17  V8P   67  
V8P  H18  H18  H  0  1  N  N  N  10.108  33.514  73.261    9.159   -2.166  -0.802  H18  V8P   68  
V8P  H19  H19  H  0  1  N  N  N   8.638  33.307  72.249    8.511   -2.408   0.838  H19  V8P   69  
V8P  H20  H20  H  0  1  N  N  N   7.828  31.600  72.725   10.820   -3.992  -0.414  H20  V8P   70  
V8P  H21  H21  H  0  1  N  N  N   8.319  30.453  71.433   10.172   -4.234   1.226  H21  V8P   71  
V8P  H22  H22  H  0  1  N  N  N  10.911  33.044  70.510    6.931   -2.686  -1.758  H22  V8P   72  
V8P  H23  H23  H  0  1  N  N  N  11.188  34.493  71.536    6.283   -2.928  -0.118  H23  V8P   73  
V8P  H24  H24  H  0  1  N  N  N   8.699  35.089  70.982    6.850   -0.582   0.451  H24  V8P   74  
V8P  H25  H25  H  0  1  N  N  N   8.866  33.893  69.653    7.498   -0.340  -1.189  H25  V8P   75  
V8P  H26  H26  H  0  1  N  N  N   8.101  36.134  68.853    5.190    1.244   0.064  H26  V8P   76  
V8P  H27  H27  H  0  1  N  N  N   9.213  35.768  67.491    5.838    1.486  -1.576  H27  V8P   77  
V8P  H28  H28  H  0  1  N  N  N  10.943  35.160  68.894    5.270   -0.860  -2.146  H28  V8P   78  
V8P  H29  H29  H  0  1  N  N  N  10.538  36.422  70.107    4.622   -1.102  -0.506  H29  V8P   79  
V8P  H30  H30  H  0  1  N  N  N  10.482  37.944  68.528    3.610    0.966  -2.533  H30  V8P   80  
V8P  H31  H31  H  0  1  N  N  N   8.797  38.328  69.019    2.962    0.725  -0.893  H31  V8P   81  
V8P  H32  H32  H  0  1  N  N  N   9.198  41.438  65.415    2.375    5.088  -2.428  H32  V8P   82  
V8P  H33  H33  H  0  1  N  N  N   8.019  40.091  65.265    0.705    4.796  -1.887  H33  V8P   83  
V8P  H34  H34  H  0  1  N  N  N   9.633  37.615  66.160    3.616    3.086  -0.339  H34  V8P   84  
V8P  H35  H35  H  0  1  N  N  N   9.258  40.327  67.526    1.811    2.727  -2.774  H35  V8P   85  
V8P  H36  H36  H  0  1  N  N  N  13.536  39.513  66.768   -0.671    0.419   0.010  H36  V8P   86  
V8P  H37  H37  H  0  1  N  N  N  13.772  41.160  66.089   -1.250    1.993   0.607  H37  V8P   87  
V8P  H38  H38  H  0  1  N  N  N  13.457  41.829  68.689   -2.289    0.605  -1.903  H38  V8P   88  
V8P  H39  H39  H  0  1  N  N  N  15.802  41.772  68.696   -3.236    2.939  -0.459  H39  V8P   89  
V8P  H40  H40  H  0  1  N  N  N  13.099  39.588  69.538   -2.845   -0.600   0.229  H40  V8P   90  
V8P  H41  H41  H  0  1  N  N  N  14.568  38.980  68.704   -3.585    0.898   0.843  H41  V8P   91  
V8P  H42  H42  H  0  1  N  N  N  15.898  39.608  70.429   -5.161    0.904  -1.072  H42  V8P   92  
V8P  H43  H43  H  0  1  N  N  N  15.202  41.264  70.442   -4.421   -0.594  -1.685  H43  V8P   93  
V8P  H44  H44  H  0  1  N  N  N  14.383  40.646  72.483   -5.050   -1.762   0.409  H44  V8P   94  
V8P  H45  H45  H  0  1  N  N  N  13.122  39.810  71.514   -5.790   -0.264   1.023  H45  V8P   95  
V8P  H46  H46  H  0  1  N  N  N  13.786  37.831  72.388   -7.365   -0.258  -0.892  H46  V8P   96  
V8P  H47  H47  H  0  1  N  N  N  15.410  38.063  71.656   -6.625   -1.756  -1.505  H47  V8P   97  
V8P  H48  H48  H  0  1  N  N  N  16.209  38.199  73.779   -7.254   -2.924   0.589  H48  V8P   98  
V8P  H49  H49  H  0  1  N  N  N  15.407  39.804  73.869   -7.994   -1.426   1.203  H49  V8P   99  
V8P  H50  H50  H  0  1  N  N  N  13.257  38.442  74.513   -9.569   -1.420  -0.712  H50  V8P  100  
V8P  H51  H51  H  0  1  N  N  N  14.400  37.100  74.857   -8.830   -2.918  -1.326  H51  V8P  101  
V8P  H52  H52  H  0  1  N  N  N  15.595  38.404  76.486   -9.459   -4.086   0.769  H52  V8P  102  
V8P  H53  H53  H  0  1  N  N  N  14.792  39.924  75.963  -10.199   -2.588   1.383  H53  V8P  103  
V8P  H54  H54  H  0  1  N  N  N  12.607  38.364  76.606  -11.774   -2.582  -0.532  H54  V8P  104  
V8P  H55  H55  H  0  1  N  N  N  13.819  37.763  77.787  -11.034   -4.080  -1.146  H55  V8P  105  
V8P  H56  H56  H  0  1  N  N  N  12.947  39.570  78.978  -12.403   -3.750   1.563  H56  V8P  106  
V8P  H57  H57  H  0  1  N  N  N  14.292  40.384  78.109  -11.663   -5.248   0.949  H57  V8P  107  
V8P  H58  H58  H  0  1  N  N  N  11.592  38.936  66.404    1.384    2.162   0.058  H58  V8P  108  
V8P  H59  H59  H  0  1  N  N  N   8.422  40.554  62.906    2.386    7.001  -1.025  H59  V8P  109  
V8P  H60  H60  H  0  1  N  N  N   9.714  40.107  60.919    2.419    7.980   1.239  H60  V8P  110  
V8P  H61  H61  H  0  1  N  N  N   8.634  38.294  61.937    4.431    6.971   0.438  H61  V8P  111  
V8P  H62  H62  H  0  1  N  N  N  11.927  39.243  62.830    1.956    5.113   2.185  H62  V8P  112  
V8P  H63  H63  H  0  1  N  N  N  11.737  38.004  60.869    3.279    6.481   3.633  H63  V8P  113  
V8P  H64  H64  H  0  1  N  N  N  13.235  41.073  61.943   -0.218    5.960   2.979  H64  V8P  114  
V8P  H65  H65  H  0  1  N  N  N  12.196  42.575  60.456    0.431    8.248   3.225  H65  V8P  115  
V8P  H66  H66  H  0  1  N  N  N  11.925  41.557  63.892   -0.109    5.008   0.707  H66  V8P  116  
V8P  H67  H67  H  0  1  N  N  N  11.943  43.743  61.796   -2.251    6.011   1.556  H67  V8P  117  
V8P  H68  H68  H  0  1  N  N  N  11.206  44.044  63.406   -1.814    7.538   0.753  H68  V8P  118  
V8P  H69  H69  H  0  1  N  N  N  13.483  44.515  63.360   -3.172    6.155  -0.643  H69  V8P  119  
V8P  H70  H70  H  0  1  N  N  N   7.395  37.321  66.793    4.181    3.298  -3.178  H70  V8P  120  
V8P  H71  H71  H  0  1  N  N  N  10.434  31.303  71.348    7.944   -4.754   0.269  H71  V8P  121  
V8P  H72  H72  H  0  1  N  N  N  10.591  31.300  73.137    8.592   -4.512  -1.371  H72  V8P  122  
V8P  H73  H73  H  0  1  N  N  N   9.713  29.400  73.517   10.253   -6.338  -0.984  H73  V8P  123  
V8P  H74  H74  H  0  1  N  N  N   8.343  30.130  74.420    9.605   -6.580   0.656  H74  V8P  124  
V8P  H75  H75  H  0  1  N  N  N  13.827  42.915  79.509  -16.072   -7.572   1.309  H75  V8P  125  
V8P  H76  H76  H  0  1  N  N  N  14.654  43.886  78.244  -16.812   -6.074   1.923  H76  V8P  126  
V8P  H77  H77  H  0  1  N  N  N   2.222  29.497  73.274   15.154   -9.712   2.388  H77  V8P  127  
V8P  H78  H78  H  0  1  N  N  N   2.610  27.760  73.025   15.248  -11.083   1.257  H78  V8P  128  
V8P  H79  H79  H  0  1  N  N  N   3.126  28.589  74.533   15.802   -9.470   0.748  H79  V8P  129  
#   #
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
V8P  O4A  C4A  SING  N  N    1  
V8P  O3A  C3A  SING  N  N    2  
V8P  C4A  C3A  SING  N  N    3  
V8P  C4A  C5M  SING  N  N    4  
V8P  C2A  C3A  SING  N  N    5  
V8P  C2A  O2A  SING  N  N    6  
V8P  C2A  C1A  SING  N  N    7  
V8P  C6A  C5M  SING  N  N    8  
V8P  C6A  O6A  SING  N  N    9  
V8P  C5M  O5A  SING  N  N   10  
V8P  O5A  C1A  SING  N  N   11  
V8P  C1A  O1A  SING  N  N   12  
V8P  O1A  C1   SING  N  N   13  
V8P  C1   C2   SING  N  N   14  
V8P  O3   C3   SING  N  N   15  
V8P  N2   C2   SING  N  N   16  
V8P  N2   CAA  SING  N  N   17  
V8P  C2   C3   SING  N  N   18  
V8P  C3   C4   SING  N  N   19  
V8P  CAB  CAA  SING  N  N   20  
V8P  CAB  CAC  SING  N  N   21  
V8P  CAA  OAA  DOUB  N  N   22  
V8P  O4   CAC  SING  N  N   23  
V8P  CAC  CAD  SING  N  N   24  
V8P  C4   C5   SING  N  N   25  
V8P  C5   C6   SING  N  N   26  
V8P  CAD  CAE  SING  N  N   27  
V8P  C6   C7   SING  N  N   28  
V8P  C7   C8   SING  N  N   29  
V8P  CAE  CAF  SING  N  N   30  
V8P  C8   C9   SING  N  N   31  
V8P  CAF  CAG  SING  N  N   32  
V8P  C10  C9   SING  N  N   33  
V8P  C10  C11  SING  N  N   34  
V8P  CAG  CAH  SING  N  N   35  
V8P  C11  C12  SING  N  N   36  
V8P  C21  C20  SING  N  N   37  
V8P  C21  C22  SING  N  N   38  
V8P  C20  C14  SING  N  N   39  
V8P  C13  C12  SING  N  N   40  
V8P  C13  C14  SING  N  N   41  
V8P  CAH  CAI  SING  N  N   42  
V8P  CAI  CAJ  SING  N  N   43  
V8P  CAJ  CAK  SING  N  N   44  
V8P  CAK  CAL  SING  N  N   45  
V8P  C16  CAL  SING  N  N   46  
V8P  C16  C15  SING  N  N   47  
V8P  C17  C15  SING  N  N   48  
V8P  C17  C18  SING  N  N   49  
V8P  C18  C19  SING  N  N   50  
V8P  C21  H1   SING  N  N   51  
V8P  C21  H2   SING  N  N   52  
V8P  C16  H3   SING  N  N   53  
V8P  C16  H4   SING  N  N   54  
V8P  C20  H5   SING  N  N   55  
V8P  C20  H6   SING  N  N   56  
V8P  C15  H7   SING  N  N   57  
V8P  C15  H8   SING  N  N   58  
V8P  C17  H9   SING  N  N   59  
V8P  C17  H10  SING  N  N   60  
V8P  C14  H11  SING  N  N   61  
V8P  C14  H12  SING  N  N   62  
V8P  C19  H13  SING  N  N   63  
V8P  C19  H14  SING  N  N   64  
V8P  C19  H15  SING  N  N   65  
V8P  C13  H16  SING  N  N   66  
V8P  C13  H17  SING  N  N   67  
V8P  C9   H18  SING  N  N   68  
V8P  C9   H19  SING  N  N   69  
V8P  C11  H20  SING  N  N   70  
V8P  C11  H21  SING  N  N   71  
V8P  C8   H22  SING  N  N   72  
V8P  C8   H23  SING  N  N   73  
V8P  C7   H24  SING  N  N   74  
V8P  C7   H25  SING  N  N   75  
V8P  C5   H26  SING  N  N   76  
V8P  C5   H27  SING  N  N   77  
V8P  C6   H28  SING  N  N   78  
V8P  C6   H29  SING  N  N   79  
V8P  C4   H30  SING  N  N   80  
V8P  C4   H31  SING  N  N   81  
V8P  C1   H32  SING  N  N   82  
V8P  C1   H33  SING  N  N   83  
V8P  C3   H34  SING  N  N   84  
V8P  C2   H35  SING  N  N   85  
V8P  CAB  H36  SING  N  N   86  
V8P  CAB  H37  SING  N  N   87  
V8P  CAC  H38  SING  N  N   88  
V8P  O4   H39  SING  N  N   89  
V8P  CAD  H40  SING  N  N   90  
V8P  CAD  H41  SING  N  N   91  
V8P  CAE  H42  SING  N  N   92  
V8P  CAE  H43  SING  N  N   93  
V8P  CAF  H44  SING  N  N   94  
V8P  CAF  H45  SING  N  N   95  
V8P  CAG  H46  SING  N  N   96  
V8P  CAG  H47  SING  N  N   97  
V8P  CAH  H48  SING  N  N   98  
V8P  CAH  H49  SING  N  N   99  
V8P  CAI  H50  SING  N  N  100  
V8P  CAI  H51  SING  N  N  101  
V8P  CAJ  H52  SING  N  N  102  
V8P  CAJ  H53  SING  N  N  103  
V8P  CAK  H54  SING  N  N  104  
V8P  CAK  H55  SING  N  N  105  
V8P  CAL  H56  SING  N  N  106  
V8P  CAL  H57  SING  N  N  107  
V8P  N2   H58  SING  N  N  108  
V8P  C1A  H59  SING  N  N  109  
V8P  C2A  H60  SING  N  N  110  
V8P  O2A  H61  SING  N  N  111  
V8P  C3A  H62  SING  N  N  112  
V8P  O3A  H63  SING  N  N  113  
V8P  C4A  H64  SING  N  N  114  
V8P  O4A  H65  SING  N  N  115  
V8P  C5M  H66  SING  N  N  116  
V8P  C6A  H67  SING  N  N  117  
V8P  C6A  H68  SING  N  N  118  
V8P  O6A  H69  SING  N  N  119  
V8P  O3   H70  SING  N  N  120  
V8P  C10  H71  SING  N  N  121  
V8P  C10  H72  SING  N  N  122  
V8P  C12  H73  SING  N  N  123  
V8P  C12  H74  SING  N  N  124  
V8P  C18  H75  SING  N  N  125  
V8P  C18  H76  SING  N  N  126  
V8P  C22  H77  SING  N  N  127  
V8P  C22  H78  SING  N  N  128  
V8P  C22  H79  SING  N  N  129  
#   #
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
V8P  SMILES            ACDLabs               12.01  "C(CCCCCCCCCCCCC(C(COC1C(C(O)C(C(O1)CO)O)O)NC(=O)CC(CCCCCCCCCCCCCC)O)O)C"  
V8P  InChI             InChI                 1.03   "InChI=1S/C40H79NO9/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-32(43)29-36(45)41-33(31-49-40-39(48)38(47)37(46)35(30-42)50-40)34(44)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h32-35,37-40,42-44,46-48H,3-31H2,1-2H3,(H,41,45)/t32-,33+,34-,35-,37+,38+,39-,40+/m1/s1"  
V8P  InChIKey          InChI                 1.03   BIVDLWPPMIZENJ-OGMOURDSSA-N  
V8P  SMILES_CANONICAL  CACTVS                3.385  "CCCCCCCCCCCCCC[C@@H](O)CC(=O)N[C@@H](CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)CCCCCCCCCCCCCC"  
V8P  SMILES            CACTVS                3.385  "CCCCCCCCCCCCCC[CH](O)CC(=O)N[CH](CO[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1O)[CH](O)CCCCCCCCCCCCCC"  
V8P  SMILES_CANONICAL  "OpenEye OEToolkits"  2.0.7  "CCCCCCCCCCCCCC[C@H](CC(=O)N[C@@H](CO[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)[C@@H](CCCCCCCCCCCCCC)O)O"  
V8P  SMILES            "OpenEye OEToolkits"  2.0.7  "CCCCCCCCCCCCCCC(CC(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(CCCCCCCCCCCCCC)O)O"  
#   #
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
V8P  "SYSTEMATIC NAME"  ACDLabs               12.01  "(3R)-N-[(2S,3R)-1-(alpha-D-galactopyranosyloxy)-3-hydroxyheptadecan-2-yl]-3-hydroxyheptadecanamide"  
V8P  "SYSTEMATIC NAME"  "OpenEye OEToolkits"  2.0.7  "(3~{R})-~{N}-[(2~{S},3~{R})-1-[(2~{S},3~{R},4~{S},5~{R},6~{R})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-oxidanyl-heptadecan-2-yl]-3-oxidanyl-heptadecanamide"  
#   #
loop_
_pdbx_chem_comp_audit.comp_id
_pdbx_chem_comp_audit.action_type
_pdbx_chem_comp_audit.date
_pdbx_chem_comp_audit.processing_site
V8P  "Create component"  2020-07-17  RCSB  
V8P  "Initial release"   2021-11-10  RCSB  
##
