data_UYH
#

_chem_comp.id                                   UYH
_chem_comp.name                                 "[(2~{S})-3-[(2~{R},3~{R},4~{S},5~{S},6~{R})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2-octadecanoyloxy-propyl] octadecanoate"
_chem_comp.type                                 non-polymer
_chem_comp.pdbx_type                            HETAIN
_chem_comp.formula                              "C45 H86 O10"
_chem_comp.mon_nstd_parent_comp_id              ?
_chem_comp.pdbx_synonyms                        ?
_chem_comp.pdbx_formal_charge                   0
_chem_comp.pdbx_initial_date                    2021-03-29
_chem_comp.pdbx_modified_date                   2022-02-25
_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                       787.158
_chem_comp.one_letter_code                      ?
_chem_comp.three_letter_code                    UYH
_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       7O0V
_chem_comp.pdbx_subcomponent_list               ?
_chem_comp.pdbx_processing_site                 PDBE
#   #
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
UYH  C2   C1   C  0  1  N  N  R  213.071  170.276  222.360    1.244   3.502   1.947  C2   UYH    1  
UYH  C4   C2   C  0  1  N  N  S  211.180  169.509  223.998    2.346   5.640   2.610  C4   UYH    2  
UYH  C5   C3   C  0  1  N  N  R  210.371  168.996  222.711    1.454   6.358   1.594  C5   UYH    3  
UYH  C6   C4   C  0  1  N  N  N  208.795  169.145  222.957    2.201   7.565   1.023  C6   UYH    4  
UYH  C8   C5   C  0  1  N  N  S  211.674  171.115  217.759   -1.045   3.150  -2.284  C8   UYH    5  
UYH  C9   C6   C  0  1  N  N  N  213.185  171.180  217.250    0.292   2.726  -2.894  C9   UYH    6  
UYH  O9   O1   O  0  1  N  N  N  208.890  171.110  218.013   -3.658   3.013  -2.220  O9   UYH    7  
UYH  C10  C7   C  0  1  N  N  N  209.370  170.878  216.888   -3.093   2.023  -1.819  C10  UYH    8  
UYH  O10  O2   O  0  1  N  N  N  212.953  170.501  214.597    2.704   1.835  -3.386  O10  UYH    9  
UYH  C11  C8   C  0  1  N  N  N  208.434  170.743  215.604   -3.895   0.842  -1.335  C11  UYH   10  
UYH  C12  C9   C  0  1  N  N  N  209.136  171.560  214.429   -5.387   1.155  -1.457  C12  UYH   11  
UYH  O4   O3   O  0  1  N  N  N  210.890  168.625  225.131    2.633   6.519   3.699  O4   UYH   12  
UYH  O2   O4   O  0  1  N  N  N  214.480  170.091  221.989    0.499   2.376   2.415  O2   UYH   13  
UYH  C1   C10  C  0  1  N  N  R  212.152  169.693  221.197    0.395   4.303   0.956  C1   UYH   14  
UYH  C13  C11  C  0  1  N  N  N  208.000  171.937  213.375   -6.201  -0.045  -0.967  C13  UYH   15  
UYH  C14  C12  C  0  1  N  N  N  208.743  172.351  212.022   -7.694   0.268  -1.089  C14  UYH   16  
UYH  C15  C13  C  0  1  N  N  N  207.718  173.196  211.138   -8.507  -0.932  -0.598  C15  UYH   17  
UYH  C16  C14  C  0  1  N  N  N  208.378  173.487  209.710  -10.000  -0.619  -0.720  C16  UYH   18  
UYH  C17  C15  C  0  1  N  N  N  208.603  172.124  208.898  -10.814  -1.819  -0.230  C17  UYH   19  
UYH  C18  C16  C  0  1  N  N  N  207.291  171.208  208.943  -12.307  -1.507  -0.352  C18  UYH   20  
UYH  C19  C17  C  0  1  N  N  N  207.265  170.240  207.666  -13.120  -2.706   0.139  C19  UYH   21  
UYH  C20  C18  C  0  1  N  N  N  206.573  171.062  206.476  -14.613  -2.394   0.017  C20  UYH   22  
UYH  C21  C19  C  0  1  N  N  N  206.469  170.189  205.135  -15.427  -3.593   0.507  C21  UYH   23  
UYH  C22  C20  C  0  1  N  N  N  207.905  169.998  204.443  -16.920  -3.280   0.385  C22  UYH   24  
UYH  C23  C21  C  0  1  N  N  N  208.486  171.441  204.051  -17.733  -4.480   0.876  C23  UYH   25  
UYH  C24  C22  C  0  1  N  N  N  209.545  171.298  202.855  -19.226  -4.167   0.754  C24  UYH   26  
UYH  C25  C23  C  0  1  N  N  N  208.733  171.260  201.471  -20.040  -5.367   1.245  C25  UYH   27  
UYH  C26  C24  C  0  1  N  N  N  209.667  170.727  200.281  -21.533  -5.054   1.123  C26  UYH   28  
UYH  C27  C25  C  0  1  N  N  N  209.798  169.133  200.364  -22.346  -6.254   1.613  C27  UYH   29  
UYH  C28  C26  C  0  1  N  N  N  212.981  171.718  214.854    2.358   1.740  -2.232  C28  UYH   30  
UYH  C29  C27  C  0  1  N  N  N  212.789  172.808  213.703    3.294   1.145  -1.212  C29  UYH   31  
UYH  C3   C28  C  0  1  N  N  S  212.756  169.477  223.706    1.615   4.399   3.132  C3   UYH   32  
UYH  C30  C29  C  0  1  N  N  N  212.822  172.090  212.277    4.605   0.746  -1.893  C30  UYH   33  
UYH  C31  C30  C  0  1  N  N  N  212.781  173.219  211.146    5.555   0.142  -0.858  C31  UYH   34  
UYH  C32  C31  C  0  1  N  N  N  212.714  172.523  209.706    6.866  -0.256  -1.539  C32  UYH   35  
UYH  C33  C32  C  0  1  N  N  N  212.961  173.662  208.607    7.816  -0.861  -0.504  C33  UYH   36  
UYH  C34  C33  C  0  1  N  N  N  212.348  173.206  207.201    9.127  -1.259  -1.185  C34  UYH   37  
UYH  C35  C34  C  0  1  N  N  N  212.985  171.807  206.754   10.077  -1.863  -0.149  C35  UYH   38  
UYH  C36  C35  C  0  1  N  N  N  212.382  171.422  205.321   11.388  -2.261  -0.831  C36  UYH   39  
UYH  C37  C36  C  0  1  N  N  N  212.864  169.954  204.906   12.338  -2.866   0.205  C37  UYH   40  
UYH  C38  C37  C  0  1  N  N  N  214.438  169.934  204.610   13.649  -3.264  -0.477  C38  UYH   41  
UYH  C39  C38  C  0  1  N  N  N  214.781  168.649  203.717   14.599  -3.868   0.559  C39  UYH   42  
UYH  C40  C39  C  0  1  N  N  N  214.227  168.831  202.223   15.910  -4.267  -0.123  C40  UYH   43  
UYH  C41  C40  C  0  1  N  N  N  215.108  169.938  201.472   16.860  -4.871   0.913  C41  UYH   44  
UYH  C42  C41  C  0  1  N  N  N  214.612  170.135  199.961   18.171  -5.269   0.231  C42  UYH   45  
UYH  C43  C42  C  0  1  N  N  N  215.650  171.096  199.204   19.121  -5.873   1.267  C43  UYH   46  
UYH  C44  C43  C  0  1  N  N  N  215.295  171.157  197.643   20.432  -6.272   0.585  C44  UYH   47  
UYH  C45  C44  C  0  1  N  N  N  216.484  171.894  196.859   21.382  -6.876   1.621  C45  UYH   48  
UYH  C7   C45  C  0  1  N  N  N  211.582  170.004  218.892   -0.792   4.106  -1.116  C7   UYH   49  
UYH  O1   O5   O  0  1  N  N  N  212.357  170.512  220.015    0.092   3.489  -0.179  O1   UYH   50  
UYH  O3   O6   O  0  1  N  N  N  213.474  170.121  224.812    2.469   3.682   4.025  O3   UYH   51  
UYH  O5   O7   O  0  1  N  N  N  208.294  167.950  223.651    1.329   8.302   0.163  O5   UYH   52  
UYH  O6   O8   O  0  1  N  N  N  210.739  169.815  221.557    1.121   5.459   0.534  O6   UYH   53  
UYH  O7   O9   O  0  1  N  N  N  210.808  170.730  216.652   -1.752   1.976  -1.804  O7   UYH   54  
UYH  O8   O10  O  0  1  N  N  N  213.262  172.202  216.208    1.141   2.164  -1.859  O8   UYH   55  
UYH  H1   H1   H  0  1  N  N  N  212.839  171.341  222.508    2.153   3.158   1.452  H1   UYH   56  
UYH  H2   H2   H  0  1  N  N  N  210.878  170.543  224.221    3.277   5.340   2.129  H2   UYH   57  
UYH  H3   H3   H  0  1  N  N  N  210.609  167.937  222.535    0.541   6.695   2.085  H3   UYH   58  
UYH  H4   H4   H  0  1  N  N  N  208.602  170.035  223.574    2.533   8.206   1.839  H4   UYH   59  
UYH  H5   H5   H  0  1  N  N  N  208.281  169.250  221.990    3.066   7.222   0.455  H5   UYH   60  
UYH  H6   H6   H  0  1  N  N  N  211.384  172.091  218.175   -1.647   3.652  -3.041  H6   UYH   61  
UYH  H7   H7   H  0  1  N  N  N  213.484  170.204  216.840    0.118   1.977  -3.667  H7   UYH   62  
UYH  H8   H8   H  0  1  N  N  N  213.850  171.446  218.085    0.783   3.594  -3.334  H8   UYH   63  
UYH  H9   H9   H  0  1  N  N  N  207.440  171.164  215.815   -3.655  -0.032  -1.941  H9   UYH   64  
UYH  H10  H10  H  0  1  N  N  N  208.332  169.685  215.320   -3.650   0.639  -0.293  H10  UYH   65  
UYH  H11  H11  H  0  1  N  N  N  209.907  170.941  213.947   -5.627   2.028  -0.851  H11  UYH   66  
UYH  H12  H12  H  0  1  N  N  N  209.598  172.475  214.829   -5.632   1.357  -2.500  H12  UYH   67  
UYH  H13  H13  H  0  1  N  N  N  211.367  168.924  225.897    3.193   6.128   4.383  H13  UYH   68  
UYH  H14  H14  H  0  1  N  N  N  215.037  170.436  222.677    0.231   1.764   1.716  H14  UYH   69  
UYH  H15  H15  H  0  1  N  N  N  212.424  168.644  221.009   -0.532   4.612   1.440  H15  UYH   70  
UYH  H16  H16  H  0  1  N  N  N  207.400  172.779  213.750   -5.962  -0.919  -1.573  H16  UYH   71  
UYH  H17  H17  H  0  1  N  N  N  207.346  171.071  213.198   -5.956  -0.248   0.076  H17  UYH   72  
UYH  H18  H18  H  0  1  N  N  N  209.053  171.449  211.475   -7.933   1.141  -0.483  H18  UYH   73  
UYH  H19  H19  H  0  1  N  N  N  209.628  172.961  212.254   -7.938   0.470  -2.132  H19  UYH   74  
UYH  H20  H20  H  0  1  N  N  N  207.494  174.148  211.642   -8.268  -1.806  -1.204  H20  UYH   75  
UYH  H21  H21  H  0  1  N  N  N  206.788  172.624  211.005   -8.263  -1.135   0.444  H21  UYH   76  
UYH  H22  H22  H  0  1  N  N  N  209.348  173.984  209.856  -10.240   0.254  -0.114  H22  UYH   77  
UYH  H23  H23  H  0  1  N  N  N  207.712  174.145  209.132  -10.245  -0.417  -1.763  H23  UYH   78  
UYH  H24  H24  H  0  1  N  N  N  209.443  171.572  209.346  -10.575  -2.693  -0.836  H24  UYH   79  
UYH  H25  H25  H  0  1  N  N  N  208.839  172.364  207.851  -10.569  -2.022   0.813  H25  UYH   80  
UYH  H26  H26  H  0  1  N  N  N  206.397  171.849  208.934  -12.546  -0.633   0.254  H26  UYH   81  
UYH  H27  H27  H  0  1  N  N  N  207.299  170.602  209.861  -12.551  -1.304  -1.394  H27  UYH   82  
UYH  H28  H28  H  0  1  N  N  N  206.682  169.334  207.889  -12.881  -3.579  -0.467  H28  UYH   83  
UYH  H29  H29  H  0  1  N  N  N  208.290  169.957  207.385  -12.876  -2.909   1.182  H29  UYH   84  
UYH  H30  H30  H  0  1  N  N  N  207.171  171.962  206.270  -14.852  -1.520   0.623  H30  UYH   85  
UYH  H31  H31  H  0  1  N  N  N  205.561  171.358  206.788  -14.858  -2.191  -1.026  H31  UYH   86  
UYH  H32  H32  H  0  1  N  N  N  205.797  170.698  204.429  -15.188  -4.466  -0.098  H32  UYH   87  
UYH  H33  H33  H  0  1  N  N  N  206.058  169.200  205.384  -15.182  -3.796   1.550  H33  UYH   88  
UYH  H34  H34  H  0  1  N  N  N  207.800  169.383  203.537  -17.159  -2.407   0.991  H34  UYH   89  
UYH  H35  H35  H  0  1  N  N  N  208.591  169.502  205.145  -17.164  -3.078  -0.657  H35  UYH   90  
UYH  H36  H36  H  0  1  N  N  N  208.983  171.884  204.927  -17.494  -5.353   0.270  H36  UYH   91  
UYH  H37  H37  H  0  1  N  N  N  207.659  172.092  203.730  -17.489  -4.682   1.919  H37  UYH   92  
UYH  H38  H38  H  0  1  N  N  N  210.120  170.368  202.975  -19.465  -3.294   1.360  H38  UYH   93  
UYH  H39  H39  H  0  1  N  N  N  210.232  172.157  202.861  -19.471  -3.964  -0.289  H39  UYH   94  
UYH  H40  H40  H  0  1  N  N  N  208.384  172.275  201.229  -19.801  -6.240   0.639  H40  UYH   95  
UYH  H41  H41  H  0  1  N  N  N  207.867  170.590  201.578  -19.795  -5.569   2.287  H41  UYH   96  
UYH  H42  H42  H  0  1  N  N  N  210.665  171.180  200.370  -21.772  -4.181   1.729  H42  UYH   97  
UYH  H43  H43  H  0  1  N  N  N  209.222  171.007  199.315  -21.777  -4.852   0.080  H43  UYH   98  
UYH  H44  H44  H  0  1  N  N  N  210.439  168.774  199.546  -22.107  -7.127   1.007  H44  UYH   99  
UYH  H45  H45  H  0  1  N  N  N  210.244  168.852  201.329  -22.102  -6.457   2.656  H45  UYH  100  
UYH  H46  H46  H  0  1  N  N  N  208.801  168.678  200.274  -23.410  -6.031   1.526  H46  UYH  101  
UYH  H47  H47  H  0  1  N  N  N  213.601  173.548  213.760    3.499   1.880  -0.433  H47  UYH  102  
UYH  H48  H48  H  0  1  N  N  N  211.822  173.315  213.836    2.834   0.263  -0.767  H48  UYH  103  
UYH  H49  H49  H  0  1  N  N  N  213.077  168.432  223.587    0.709   4.703   3.656  H49  UYH  104  
UYH  H50  H50  H  0  1  N  N  N  211.950  171.428  212.174    4.401   0.011  -2.672  H50  UYH  105  
UYH  H51  H51  H  0  1  N  N  N  213.745  171.499  212.179    5.066   1.628  -2.339  H51  UYH  106  
UYH  H52  H52  H  0  1  N  N  N  213.687  173.839  211.213    5.760   0.877  -0.079  H52  UYH  107  
UYH  H53  H53  H  0  1  N  N  N  211.893  173.851  211.290    5.095  -0.740  -0.413  H53  UYH  108  
UYH  H54  H54  H  0  1  N  N  N  211.725  172.065  209.556    6.662  -0.992  -2.318  H54  UYH  109  
UYH  H55  H55  H  0  1  N  N  N  213.492  171.750  209.626    7.327   0.626  -1.984  H55  UYH  110  
UYH  H56  H56  H  0  1  N  N  N  214.042  173.832  208.495    8.020  -0.125   0.275  H56  UYH  111  
UYH  H57  H57  H  0  1  N  N  N  212.475  174.594  208.932    7.356  -1.742  -0.059  H57  UYH  112  
UYH  H58  H58  H  0  1  N  N  N  212.573  173.968  206.441    8.923  -1.994  -1.964  H58  UYH  113  
UYH  H59  H59  H  0  1  N  N  N  211.258  173.096  207.298    9.588  -0.377  -1.630  H59  UYH  114  
UYH  H60  H60  H  0  1  N  N  N  212.728  171.029  207.488   10.281  -1.128   0.629  H60  UYH  115  
UYH  H61  H61  H  0  1  N  N  N  214.079  171.900  206.686    9.616  -2.745   0.296  H61  UYH  116  
UYH  H62  H62  H  0  1  N  N  N  212.732  172.147  204.571   11.184  -2.997  -1.610  H62  UYH  117  
UYH  H63  H63  H  0  1  N  N  N  211.283  171.446  205.369   11.849  -1.380  -1.276  H63  UYH  118  
UYH  H64  H64  H  0  1  N  N  N  212.323  169.639  204.001   12.542  -2.131   0.983  H64  UYH  119  
UYH  H65  H65  H  0  1  N  N  N  212.643  169.256  205.727   11.877  -3.748   0.650  H65  UYH  120  
UYH  H66  H66  H  0  1  N  N  N  214.992  169.883  205.559   13.445  -3.999  -1.255  H66  UYH  121  
UYH  H67  H67  H  0  1  N  N  N  214.724  170.848  204.068   14.109  -2.382  -0.922  H67  UYH  122  
UYH  H68  H68  H  0  1  N  N  N  214.315  167.761  204.169   14.803  -3.133   1.337  H68  UYH  123  
UYH  H69  H69  H  0  1  N  N  N  215.872  168.514  203.683   14.138  -4.750   1.004  H69  UYH  124  
UYH  H70  H70  H  0  1  N  N  N  213.177  169.156  202.256   15.706  -5.002  -0.901  H70  UYH  125  
UYH  H71  H71  H  0  1  N  N  N  214.298  167.875  201.684   16.370  -3.385  -0.568  H71  UYH  126  
UYH  H72  H72  H  0  1  N  N  N  216.160  169.618  201.467   17.064  -4.136   1.691  H72  UYH  127  
UYH  H73  H73  H  0  1  N  N  N  215.018  170.894  202.008   16.399  -5.753   1.358  H73  UYH  128  
UYH  H74  H74  H  0  1  N  N  N  213.612  170.592  199.956   17.966  -6.004  -0.547  H74  UYH  129  
UYH  H75  H75  H  0  1  N  N  N  214.572  169.160  199.454   18.631  -4.387  -0.214  H75  UYH  130  
UYH  H76  H76  H  0  1  N  N  N  216.670  170.704  199.331   19.325  -5.138   2.045  H76  UYH  131  
UYH  H77  H77  H  0  1  N  N  N  215.590  172.108  199.632   18.660  -6.755   1.712  H77  UYH  132  
UYH  H78  H78  H  0  1  N  N  N  214.359  171.716  197.500   20.227  -7.007  -0.193  H78  UYH  133  
UYH  H79  H79  H  0  1  N  N  N  215.175  170.135  197.253   20.892  -5.390   0.140  H79  UYH  134  
UYH  H80  H80  H  0  1  N  N  N  216.244  171.938  195.786   20.921  -7.758   2.066  H80  UYH  135  
UYH  H81  H81  H  0  1  N  N  N  216.603  172.915  197.250   22.316  -7.160   1.135  H81  UYH  136  
UYH  H82  H82  H  0  1  N  N  N  217.420  171.334  197.003   21.586  -6.141   2.399  H82  UYH  137  
UYH  H83  H83  H  0  1  N  N  N  210.535  169.847  219.190   -0.342   5.025  -1.491  H83  UYH  138  
UYH  H84  H84  H  0  1  N  N  N  212.007  169.055  218.532   -1.738   4.338  -0.626  H84  UYH  139  
UYH  H85  H85  H  0  1  N  N  N  213.295  169.655  225.620    2.072   2.879   4.390  H85  UYH  140  
UYH  H86  H86  H  0  1  N  N  N  207.359  168.037  223.798    1.737   9.083  -0.235  H86  UYH  141  
#   #
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
UYH  C45  C44  SING  N  N    1  
UYH  C44  C43  SING  N  N    2  
UYH  C43  C42  SING  N  N    3  
UYH  C42  C41  SING  N  N    4  
UYH  C26  C27  SING  N  N    5  
UYH  C26  C25  SING  N  N    6  
UYH  C25  C24  SING  N  N    7  
UYH  C41  C40  SING  N  N    8  
UYH  C40  C39  SING  N  N    9  
UYH  C24  C23  SING  N  N   10  
UYH  C39  C38  SING  N  N   11  
UYH  C23  C22  SING  N  N   12  
UYH  C22  C21  SING  N  N   13  
UYH  C38  C37  SING  N  N   14  
UYH  C37  C36  SING  N  N   15  
UYH  C21  C20  SING  N  N   16  
UYH  C36  C35  SING  N  N   17  
UYH  C20  C19  SING  N  N   18  
UYH  C35  C34  SING  N  N   19  
UYH  C34  C33  SING  N  N   20  
UYH  C19  C18  SING  N  N   21  
UYH  C33  C32  SING  N  N   22  
UYH  C17  C18  SING  N  N   23  
UYH  C17  C16  SING  N  N   24  
UYH  C32  C31  SING  N  N   25  
UYH  C16  C15  SING  N  N   26  
UYH  C15  C14  SING  N  N   27  
UYH  C31  C30  SING  N  N   28  
UYH  C14  C13  SING  N  N   29  
UYH  C30  C29  SING  N  N   30  
UYH  C13  C12  SING  N  N   31  
UYH  C29  C28  SING  N  N   32  
UYH  C12  C11  SING  N  N   33  
UYH  O10  C28  DOUB  N  N   34  
UYH  C28  O8   SING  N  N   35  
UYH  C11  C10  SING  N  N   36  
UYH  O8   C9   SING  N  N   37  
UYH  O7   C10  SING  N  N   38  
UYH  O7   C8   SING  N  N   39  
UYH  C10  O9   DOUB  N  N   40  
UYH  C9   C8   SING  N  N   41  
UYH  C8   C7   SING  N  N   42  
UYH  C7   O1   SING  N  N   43  
UYH  O1   C1   SING  N  N   44  
UYH  C1   O6   SING  N  N   45  
UYH  C1   C2   SING  N  N   46  
UYH  O6   C5   SING  N  N   47  
UYH  O2   C2   SING  N  N   48  
UYH  C2   C3   SING  N  N   49  
UYH  C5   C6   SING  N  N   50  
UYH  C5   C4   SING  N  N   51  
UYH  C6   O5   SING  N  N   52  
UYH  C3   C4   SING  N  N   53  
UYH  C3   O3   SING  N  N   54  
UYH  C4   O4   SING  N  N   55  
UYH  C2   H1   SING  N  N   56  
UYH  C4   H2   SING  N  N   57  
UYH  C5   H3   SING  N  N   58  
UYH  C6   H4   SING  N  N   59  
UYH  C6   H5   SING  N  N   60  
UYH  C8   H6   SING  N  N   61  
UYH  C9   H7   SING  N  N   62  
UYH  C9   H8   SING  N  N   63  
UYH  C11  H9   SING  N  N   64  
UYH  C11  H10  SING  N  N   65  
UYH  C12  H11  SING  N  N   66  
UYH  C12  H12  SING  N  N   67  
UYH  O4   H13  SING  N  N   68  
UYH  O2   H14  SING  N  N   69  
UYH  C1   H15  SING  N  N   70  
UYH  C13  H16  SING  N  N   71  
UYH  C13  H17  SING  N  N   72  
UYH  C14  H18  SING  N  N   73  
UYH  C14  H19  SING  N  N   74  
UYH  C15  H20  SING  N  N   75  
UYH  C15  H21  SING  N  N   76  
UYH  C16  H22  SING  N  N   77  
UYH  C16  H23  SING  N  N   78  
UYH  C17  H24  SING  N  N   79  
UYH  C17  H25  SING  N  N   80  
UYH  C18  H26  SING  N  N   81  
UYH  C18  H27  SING  N  N   82  
UYH  C19  H28  SING  N  N   83  
UYH  C19  H29  SING  N  N   84  
UYH  C20  H30  SING  N  N   85  
UYH  C20  H31  SING  N  N   86  
UYH  C21  H32  SING  N  N   87  
UYH  C21  H33  SING  N  N   88  
UYH  C22  H34  SING  N  N   89  
UYH  C22  H35  SING  N  N   90  
UYH  C23  H36  SING  N  N   91  
UYH  C23  H37  SING  N  N   92  
UYH  C24  H38  SING  N  N   93  
UYH  C24  H39  SING  N  N   94  
UYH  C25  H40  SING  N  N   95  
UYH  C25  H41  SING  N  N   96  
UYH  C26  H42  SING  N  N   97  
UYH  C26  H43  SING  N  N   98  
UYH  C27  H44  SING  N  N   99  
UYH  C27  H45  SING  N  N  100  
UYH  C27  H46  SING  N  N  101  
UYH  C29  H47  SING  N  N  102  
UYH  C29  H48  SING  N  N  103  
UYH  C3   H49  SING  N  N  104  
UYH  C30  H50  SING  N  N  105  
UYH  C30  H51  SING  N  N  106  
UYH  C31  H52  SING  N  N  107  
UYH  C31  H53  SING  N  N  108  
UYH  C32  H54  SING  N  N  109  
UYH  C32  H55  SING  N  N  110  
UYH  C33  H56  SING  N  N  111  
UYH  C33  H57  SING  N  N  112  
UYH  C34  H58  SING  N  N  113  
UYH  C34  H59  SING  N  N  114  
UYH  C35  H60  SING  N  N  115  
UYH  C35  H61  SING  N  N  116  
UYH  C36  H62  SING  N  N  117  
UYH  C36  H63  SING  N  N  118  
UYH  C37  H64  SING  N  N  119  
UYH  C37  H65  SING  N  N  120  
UYH  C38  H66  SING  N  N  121  
UYH  C38  H67  SING  N  N  122  
UYH  C39  H68  SING  N  N  123  
UYH  C39  H69  SING  N  N  124  
UYH  C40  H70  SING  N  N  125  
UYH  C40  H71  SING  N  N  126  
UYH  C41  H72  SING  N  N  127  
UYH  C41  H73  SING  N  N  128  
UYH  C42  H74  SING  N  N  129  
UYH  C42  H75  SING  N  N  130  
UYH  C43  H76  SING  N  N  131  
UYH  C43  H77  SING  N  N  132  
UYH  C44  H78  SING  N  N  133  
UYH  C44  H79  SING  N  N  134  
UYH  C45  H80  SING  N  N  135  
UYH  C45  H81  SING  N  N  136  
UYH  C45  H82  SING  N  N  137  
UYH  C7   H83  SING  N  N  138  
UYH  C7   H84  SING  N  N  139  
UYH  O3   H85  SING  N  N  140  
UYH  O5   H86  SING  N  N  141  
#   #
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
UYH  InChI             InChI                 1.03   "InChI=1S/C45H86O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(47)52-36-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)54-41(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h38-39,42-46,49-51H,3-37H2,1-2H3/t38-,39-,42-,43+,44-,45-/m1/s1"  
UYH  InChIKey          InChI                 1.03   DCLTVZLYPPIIID-KTXJEQRFSA-N  
UYH  SMILES_CANONICAL  CACTVS                3.385  "CCCCCCCCCCCCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCCCCCCCCCCCC"  
UYH  SMILES            CACTVS                3.385  "CCCCCCCCCCCCCCCCCC(=O)OC[CH](CO[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1O)OC(=O)CCCCCCCCCCCCCCCCC"  
UYH  SMILES_CANONICAL  "OpenEye OEToolkits"  2.0.7  "CCCCCCCCCCCCCCCCCC(=O)OC[C@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)OC(=O)CCCCCCCCCCCCCCCCC"  
UYH  SMILES            "OpenEye OEToolkits"  2.0.7  "CCCCCCCCCCCCCCCCCC(=O)OCC(COC1C(C(C(C(O1)CO)O)O)O)OC(=O)CCCCCCCCCCCCCCCCC"  
#
_pdbx_chem_comp_identifier.comp_id          UYH
_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~{S})-3-[(2~{R},3~{R},4~{S},5~{S},6~{R})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2-octadecanoyloxy-propyl] octadecanoate"
#   #
loop_
_pdbx_chem_comp_audit.comp_id
_pdbx_chem_comp_audit.action_type
_pdbx_chem_comp_audit.date
_pdbx_chem_comp_audit.processing_site
UYH  "Create component"  2021-03-29  PDBE  
UYH  "Initial release"   2022-03-02  RCSB  
##
