data_A1EW5
# 
_chem_comp.id                                    A1EW5 
_chem_comp.name                                  "[(2~{S})-2-[(~{Z})-octadec-9-enoyl]oxy-3-oxidanyl-propyl] (~{Z})-octadec-9-enoate" 
_chem_comp.type                                  non-polymer 
_chem_comp.pdbx_type                             HETAIN 
_chem_comp.formula                               "C39 H72 O5" 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         1,2-Dioleoyl-sn-glycerol 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     2025-09-05 
_chem_comp.pdbx_modified_date                    2025-10-31 
_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                        620.986 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     A1EW5 
_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        9VJX 
_chem_comp.pdbx_subcomponent_list                ? 
_chem_comp.pdbx_processing_site                  PDBC 
_chem_comp.pdbx_pcm                              ? 
# 
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.pdbx_n_terminal_atom_flag 
_chem_comp_atom.pdbx_backbone_atom_flag 
_chem_comp_atom.pdbx_c_terminal_atom_flag 
_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 
A1EW5 C01 C1  C 0 1 N N N N N N 130.752 123.638 116.172 17.736  5.030  -4.524 C01 A1EW5 1   
A1EW5 C02 C2  C 0 1 N N N N N N 132.112 123.660 116.900 16.693  3.984  -4.127 C02 A1EW5 2   
A1EW5 C03 C3  C 0 1 N N N N N N 132.204 122.605 118.032 16.328  4.162  -2.652 C03 A1EW5 3   
A1EW5 C04 C4  C 0 1 N N N N N N 132.325 121.180 117.456 15.284  3.116  -2.254 C04 A1EW5 4   
A1EW5 C05 C5  C 0 1 N N N N N N 133.530 120.406 118.036 14.919  3.295  -0.780 C05 A1EW5 5   
A1EW5 C06 C6  C 0 1 N N N N N N 133.193 119.484 119.237 13.875  2.249  -0.382 C06 A1EW5 6   
A1EW5 C07 C7  C 0 1 N N N N N N 134.472 118.723 119.660 13.510  2.428  1.093  C07 A1EW5 7   
A1EW5 C08 C8  C 0 1 N N N N N N 135.400 119.574 120.565 12.466  1.381  1.490  C08 A1EW5 8   
A1EW5 C09 C9  C 0 1 N N N N N N 135.828 118.762 121.812 12.106  1.558  2.943  C09 A1EW5 9   
A1EW5 C10 C10 C 0 1 N N N N N N 135.778 118.192 123.029 10.850  1.671  3.297  C10 A1EW5 10  
A1EW5 C11 C11 C 0 1 N N N N N N 135.213 117.677 124.381 9.758   1.456  2.281  C11 A1EW5 11  
A1EW5 C12 C12 C 0 1 N N N N N N 136.466 117.129 125.126 8.774   0.408  2.804  C12 A1EW5 12  
A1EW5 C13 C13 C 0 1 N N N N N N 136.216 116.253 126.386 7.665   0.189  1.773  C13 A1EW5 13  
A1EW5 C14 C14 C 0 1 N N N N N N 136.004 114.754 126.001 6.681   -0.858 2.296  C14 A1EW5 14  
A1EW5 C15 C15 C 0 1 N N N N N N 135.036 113.933 126.917 5.572   -1.077 1.264  C15 A1EW5 15  
A1EW5 C16 C16 C 0 1 N N N N N N 135.727 113.116 128.069 4.588   -2.124 1.788  C16 A1EW5 16  
A1EW5 C17 C17 C 0 1 N N N N N N 136.230 113.905 129.321 3.479   -2.343 0.756  C17 A1EW5 17  
A1EW5 C18 C18 C 0 1 N N N N N N 136.271 113.018 130.598 2.509   -3.375 1.272  C18 A1EW5 18  
A1EW5 C21 C19 C 0 1 N N N N N N 134.729 112.326 132.299 0.557   -4.729 1.089  C21 A1EW5 19  
A1EW5 C22 C20 C 0 1 N N S N N N 133.307 112.879 132.557 -0.585  -5.001 0.107  C22 A1EW5 20  
A1EW5 C23 C21 C 0 1 N N N N N N 132.559 112.087 133.638 -0.004  -5.394 -1.253 C23 A1EW5 21  
A1EW5 C26 C22 C 0 1 N N N N N N 132.321 112.030 130.341 -2.695  -3.978 -0.317 C26 A1EW5 22  
A1EW5 C28 C23 C 0 1 N N N N N N 132.075 112.526 128.879 -3.596  -2.782 -0.483 C28 A1EW5 23  
A1EW5 C29 C24 C 0 1 N N N N N N 130.669 113.182 128.768 -5.019  -3.254 -0.790 C29 A1EW5 24  
A1EW5 C30 C25 C 0 1 N N N N N N 130.608 114.520 127.974 -5.934  -2.039 -0.959 C30 A1EW5 25  
A1EW5 C31 C26 C 0 1 N N N N N N 130.559 114.342 126.427 -7.356  -2.511 -1.267 C31 A1EW5 26  
A1EW5 C32 C27 C 0 1 N N N N N N 129.877 115.549 125.715 -8.272  -1.297 -1.436 C32 A1EW5 27  
A1EW5 C33 C28 C 0 1 N N N N N N 130.286 115.647 124.217 -9.694  -1.769 -1.743 C33 A1EW5 28  
A1EW5 C34 C29 C 0 1 N N N N N N 129.326 116.509 123.345 -10.609 -0.554 -1.912 C34 A1EW5 29  
A1EW5 C35 C30 C 0 1 N N N N N N 130.166 117.452 122.447 -12.010 -1.020 -2.215 C35 A1EW5 30  
A1EW5 C36 C31 C 0 1 N N N N N N 129.618 118.312 121.573 -13.016 -0.580 -1.499 C36 A1EW5 31  
A1EW5 C37 C32 C 0 1 N N N N N N 128.093 118.465 121.386 -12.798 0.515  -0.487 C37 A1EW5 32  
A1EW5 C38 C33 C 0 1 N N N N N N 127.780 119.298 120.114 -13.784 1.655  -0.750 C38 A1EW5 33  
A1EW5 C39 C34 C 0 1 N N N N N N 126.890 120.550 120.349 -13.563 2.767  0.277  C39 A1EW5 34  
A1EW5 C40 C35 C 0 1 N N N N N N 127.664 121.803 120.823 -14.549 3.908  0.014  C40 A1EW5 35  
A1EW5 C41 C36 C 0 1 N N N N N N 126.850 122.692 121.792 -14.328 5.019  1.042  C41 A1EW5 36  
A1EW5 C42 C37 C 0 1 N N N N N N 127.682 123.880 122.325 -15.314 6.160  0.779  C42 A1EW5 37  
A1EW5 C43 C38 C 0 1 N N N N N N 126.946 124.693 123.412 -15.093 7.272  1.807  C43 A1EW5 38  
A1EW5 C44 C39 C 0 1 N N N N N N 127.905 125.590 124.219 -16.079 8.412  1.544  C44 A1EW5 39  
A1EW5 O19 O1  O 0 1 N N N N N N 136.952 112.045 130.635 2.687   -3.883 2.353  O19 A1EW5 40  
A1EW5 O20 O2  O 0 1 N N N N N N 135.472 113.392 131.723 1.449   -3.729 0.529  O20 A1EW5 41  
A1EW5 O24 O3  O 0 1 N N N N N N 131.210 112.501 133.633 0.899   -4.379 -1.697 O24 A1EW5 42  
A1EW5 O25 O4  O 0 1 N N N N N N 132.577 113.047 131.343 -1.393  -3.804 -0.040 O25 A1EW5 43  
A1EW5 O27 O5  O 0 1 N N N N N N 132.290 110.850 130.534 -3.144  -5.093 -0.433 O27 A1EW5 44  
A1EW5 H1  H1  H 0 1 N N N N N N 130.745 124.404 115.383 18.629  4.904  -3.911 H1  A1EW5 45  
A1EW5 H2  H2  H 0 1 N N N N N N 130.593 122.647 115.722 17.997  4.902  -5.575 H2  A1EW5 46  
A1EW5 H3  H3  H 0 1 N N N N N N 129.947 123.847 116.892 17.327  6.028  -4.370 H3  A1EW5 47  
A1EW5 H4  H4  H 0 1 N N N N N N 132.907 123.459 116.167 15.801  4.109  -4.740 H4  A1EW5 48  
A1EW5 H5  H5  H 0 1 N N N N N N 132.261 124.658 117.337 17.103  2.985  -4.281 H5  A1EW5 49  
A1EW5 H6  H6  H 0 1 N N N N N N 133.088 122.818 118.651 17.220  4.037  -2.038 H6  A1EW5 50  
A1EW5 H7  H7  H 0 1 N N N N N N 131.298 122.665 118.653 15.918  5.161  -2.497 H7  A1EW5 51  
A1EW5 H8  H8  H 0 1 N N N N N N 131.404 120.626 117.690 14.392  3.242  -2.868 H8  A1EW5 52  
A1EW5 H9  H9  H 0 1 N N N N N N 132.443 121.250 116.365 15.694  2.118  -2.409 H9  A1EW5 53  
A1EW5 H10 H10 H 0 1 N N N N N N 133.954 119.783 117.235 15.811  3.170  -0.166 H10 A1EW5 54  
A1EW5 H11 H11 H 0 1 N N N N N N 134.280 121.139 118.367 14.509  4.293  -0.625 H11 A1EW5 55  
A1EW5 H12 H12 H 0 1 N N N N N N 132.830 120.092 120.079 12.983  2.374  -0.996 H12 A1EW5 56  
A1EW5 H13 H13 H 0 1 N N N N N N 132.415 118.764 118.943 14.285  1.250  -0.537 H13 A1EW5 57  
A1EW5 H14 H14 H 0 1 N N N N N N 134.177 117.817 120.210 14.402  2.302  1.706  H14 A1EW5 58  
A1EW5 H15 H15 H 0 1 N N N N N N 135.028 118.438 118.755 13.100  3.426  1.247  H15 A1EW5 59  
A1EW5 H16 H16 H 0 1 N N N N N N 136.296 119.864 119.996 11.574  1.507  0.877  H16 A1EW5 60  
A1EW5 H17 H17 H 0 1 N N N N N N 134.862 120.478 120.888 12.876  0.383  1.336  H17 A1EW5 61  
A1EW5 H18 H18 H 0 1 N N N N N N 134.748 118.497 124.948 9.232   2.395  2.109  H18 A1EW5 62  
A1EW5 H19 H19 H 0 1 N N N N N N 134.474 116.878 124.218 10.196  1.107  1.345  H19 A1EW5 63  
A1EW5 H20 H20 H 0 1 N N N N N N 137.038 116.522 124.409 9.300   -0.531 2.977  H20 A1EW5 64  
A1EW5 H21 H21 H 0 1 N N N N N N 137.070 117.994 125.438 8.336   0.756  3.740  H21 A1EW5 65  
A1EW5 H22 H22 H 0 1 N N N N N N 137.085 116.332 127.056 7.139   1.128  1.600  H22 A1EW5 66  
A1EW5 H23 H23 H 0 1 N N N N N N 135.319 116.620 126.906 8.103   -0.159 0.837  H23 A1EW5 67  
A1EW5 H24 H24 H 0 1 N N N N N N 135.602 114.724 124.977 7.207   -1.797 2.468  H24 A1EW5 68  
A1EW5 H25 H25 H 0 1 N N N N N N 136.987 114.260 126.024 6.243   -0.510 3.231  H25 A1EW5 69  
A1EW5 H26 H26 H 0 1 N N N N N N 134.327 114.637 127.378 5.046   -0.138 1.092  H26 A1EW5 70  
A1EW5 H27 H27 H 0 1 N N N N N N 134.487 113.224 126.280 6.010   -1.425 0.329  H27 A1EW5 71  
A1EW5 H28 H28 H 0 1 N N N N N N 135.001 112.368 128.422 5.114   -3.063 1.960  H28 A1EW5 72  
A1EW5 H29 H29 H 0 1 N N N N N N 136.597 112.604 127.632 4.150   -1.776 2.723  H29 A1EW5 73  
A1EW5 H30 H30 H 0 1 N N N N N N 137.244 114.281 129.119 2.953   -1.404 0.584  H30 A1EW5 74  
A1EW5 H31 H31 H 0 1 N N N N N N 135.553 114.753 129.501 3.917   -2.691 -0.179 H31 A1EW5 75  
A1EW5 H32 H32 H 0 1 N N N N N N 134.686 111.473 131.606 0.146   -4.364 2.030  H32 A1EW5 76  
A1EW5 H33 H33 H 0 1 N N N N N N 135.191 112.007 133.245 1.110   -5.651 1.267  H33 A1EW5 77  
A1EW5 H34 H34 H 0 1 N N N N N N 133.456 113.884 132.979 -1.204  -5.814 0.486  H34 A1EW5 78  
A1EW5 H35 H35 H 0 1 N N N N N N 132.619 111.011 133.420 0.529   -6.340 -1.161 H35 A1EW5 79  
A1EW5 H36 H36 H 0 1 N N N N N N 133.006 112.287 134.623 -0.813  -5.501 -1.976 H36 A1EW5 80  
A1EW5 H37 H37 H 0 1 N N N N N N 132.133 111.671 128.190 -3.599  -2.198 0.438  H37 A1EW5 81  
A1EW5 H38 H38 H 0 1 N N N N N N 132.844 113.266 128.611 -3.233  -2.164 -1.304 H38 A1EW5 82  
A1EW5 H39 H39 H 0 1 N N N N N N 130.306 113.378 129.788 -5.017  -3.838 -1.711 H39 A1EW5 83  
A1EW5 H40 H40 H 0 1 N N N N N N 129.999 112.464 128.272 -5.382  -3.871 0.031  H40 A1EW5 84  
A1EW5 H41 H41 H 0 1 N N N N N N 131.501 115.111 128.225 -5.936  -1.455 -0.039 H41 A1EW5 85  
A1EW5 H42 H42 H 0 1 N N N N N N 129.706 115.066 128.287 -5.570  -1.421 -1.780 H42 A1EW5 86  
A1EW5 H43 H43 H 0 1 N N N N N N 129.993 113.428 126.194 -7.354  -3.095 -2.188 H43 A1EW5 87  
A1EW5 H44 H44 H 0 1 N N N N N N 131.587 114.243 126.049 -7.720  -3.129 -0.446 H44 A1EW5 88  
A1EW5 H45 H45 H 0 1 N N N N N N 130.174 116.477 126.226 -8.274  -0.713 -0.515 H45 A1EW5 89  
A1EW5 H46 H46 H 0 1 N N N N N N 128.785 115.428 125.778 -7.908  -0.679 -2.257 H46 A1EW5 90  
A1EW5 H47 H47 H 0 1 N N N N N N 130.310 114.630 123.799 -9.692  -2.353 -2.664 H47 A1EW5 91  
A1EW5 H48 H48 H 0 1 N N N N N N 131.291 116.090 124.163 -10.057 -2.387 -0.922 H48 A1EW5 92  
A1EW5 H49 H49 H 0 1 N N N N N N 128.673 117.107 123.997 -10.611 0.029  -0.992 H49 A1EW5 93  
A1EW5 H50 H50 H 0 1 N N N N N N 128.711 115.851 122.714 -10.246 0.063  -2.733 H50 A1EW5 94  
A1EW5 H51 H51 H 0 1 N N N N N N 131.242 117.416 122.528 -12.185 -1.715 -3.023 H51 A1EW5 95  
A1EW5 H52 H52 H 0 1 N N N N N N 130.274 118.925 120.973 -14.000 -1.003 -1.635 H52 A1EW5 96  
A1EW5 H53 H53 H 0 1 N N N N N N 127.670 118.974 122.265 -12.959 0.120  0.516  H53 A1EW5 97  
A1EW5 H54 H54 H 0 1 N N N N N N 127.639 117.468 121.286 -11.778 0.890  -0.571 H54 A1EW5 98  
A1EW5 H55 H55 H 0 1 N N N N N N 127.264 118.643 119.396 -13.623 2.050  -1.753 H55 A1EW5 99  
A1EW5 H56 H56 H 0 1 N N N N N N 128.735 119.634 119.683 -14.804 1.280  -0.666 H56 A1EW5 100 
A1EW5 H57 H57 H 0 1 N N N N N N 126.384 120.795 119.404 -13.724 2.372  1.281  H57 A1EW5 101 
A1EW5 H58 H58 H 0 1 N N N N N N 126.139 120.300 121.113 -12.543 3.142  0.194  H58 A1EW5 102 
A1EW5 H59 H59 H 0 1 N N N N N N 128.580 121.475 121.336 -14.388 4.303  -0.988 H59 A1EW5 103 
A1EW5 H60 H60 H 0 1 N N N N N N 127.933 122.403 119.941 -15.569 3.533  0.098  H60 A1EW5 104 
A1EW5 H61 H61 H 0 1 N N N N N N 125.971 123.084 121.260 -14.489 4.624  2.045  H61 A1EW5 105 
A1EW5 H62 H62 H 0 1 N N N N N N 126.520 122.079 122.644 -13.308 5.394  0.958  H62 A1EW5 106 
A1EW5 H63 H63 H 0 1 N N N N N N 128.617 123.489 122.753 -15.153 6.555  -0.224 H63 A1EW5 107 
A1EW5 H64 H64 H 0 1 N N N N N N 127.915 124.550 121.484 -16.334 5.785  0.863  H64 A1EW5 108 
A1EW5 H65 H65 H 0 1 N N N N N N 126.190 125.329 122.928 -15.254 6.877  2.810  H65 A1EW5 109 
A1EW5 H66 H66 H 0 1 N N N N N N 126.450 123.994 124.102 -14.073 7.647  1.723  H66 A1EW5 110 
A1EW5 H67 H67 H 0 1 N N N N N N 127.336 126.147 124.978 -15.918 8.807  0.541  H67 A1EW5 111 
A1EW5 H68 H68 H 0 1 N N N N N N 128.662 124.965 124.715 -17.099 8.037  1.628  H68 A1EW5 112 
A1EW5 H69 H69 H 0 1 N N N N N N 128.402 126.299 123.540 -15.921 9.204  2.276  H69 A1EW5 113 
A1EW5 H70 H70 H 0 1 N N N N N N 130.729 112.021 134.297 1.306   -4.563 -2.555 H70 A1EW5 114 
A1EW5 H71 H71 H 0 1 N N N N N N 136.812 118.446 121.499 12.884  1.591  3.691  H71 A1EW5 115 
A1EW5 H72 H72 H 0 1 N N N N N N 136.812 117.900 123.138 10.597  1.918  4.317  H72 A1EW5 116 
# 
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 
A1EW5 C01 C02 SING N N 1   
A1EW5 C02 C03 SING N N 2   
A1EW5 C04 C03 SING N N 3   
A1EW5 C04 C05 SING N N 4   
A1EW5 C05 C06 SING N N 5   
A1EW5 C06 C07 SING N N 6   
A1EW5 C07 C08 SING N N 7   
A1EW5 C38 C39 SING N N 8   
A1EW5 C38 C37 SING N N 9   
A1EW5 C39 C40 SING N N 10  
A1EW5 C08 C09 SING N N 11  
A1EW5 C40 C41 SING N N 12  
A1EW5 C37 C36 SING N N 13  
A1EW5 C36 C35 DOUB N Z 14  
A1EW5 C41 C42 SING N N 15  
A1EW5 C09 C10 DOUB N Z 16  
A1EW5 C42 C43 SING N N 17  
A1EW5 C35 C34 SING N N 18  
A1EW5 C10 C11 SING N N 19  
A1EW5 C34 C33 SING N N 20  
A1EW5 C43 C44 SING N N 21  
A1EW5 C33 C32 SING N N 22  
A1EW5 C11 C12 SING N N 23  
A1EW5 C12 C13 SING N N 24  
A1EW5 C32 C31 SING N N 25  
A1EW5 C14 C13 SING N N 26  
A1EW5 C14 C15 SING N N 27  
A1EW5 C31 C30 SING N N 28  
A1EW5 C15 C16 SING N N 29  
A1EW5 C30 C29 SING N N 30  
A1EW5 C16 C17 SING N N 31  
A1EW5 C29 C28 SING N N 32  
A1EW5 C28 C26 SING N N 33  
A1EW5 C17 C18 SING N N 34  
A1EW5 C26 O27 DOUB N N 35  
A1EW5 C26 O25 SING N N 36  
A1EW5 C18 O19 DOUB N N 37  
A1EW5 C18 O20 SING N N 38  
A1EW5 O25 C22 SING N N 39  
A1EW5 O20 C21 SING N N 40  
A1EW5 C21 C22 SING N N 41  
A1EW5 C22 C23 SING N N 42  
A1EW5 O24 C23 SING N N 43  
A1EW5 C01 H1  SING N N 44  
A1EW5 C01 H2  SING N N 45  
A1EW5 C01 H3  SING N N 46  
A1EW5 C02 H4  SING N N 47  
A1EW5 C02 H5  SING N N 48  
A1EW5 C03 H6  SING N N 49  
A1EW5 C03 H7  SING N N 50  
A1EW5 C04 H8  SING N N 51  
A1EW5 C04 H9  SING N N 52  
A1EW5 C05 H10 SING N N 53  
A1EW5 C05 H11 SING N N 54  
A1EW5 C06 H12 SING N N 55  
A1EW5 C06 H13 SING N N 56  
A1EW5 C07 H14 SING N N 57  
A1EW5 C07 H15 SING N N 58  
A1EW5 C08 H16 SING N N 59  
A1EW5 C08 H17 SING N N 60  
A1EW5 C11 H18 SING N N 61  
A1EW5 C11 H19 SING N N 62  
A1EW5 C12 H20 SING N N 63  
A1EW5 C12 H21 SING N N 64  
A1EW5 C13 H22 SING N N 65  
A1EW5 C13 H23 SING N N 66  
A1EW5 C14 H24 SING N N 67  
A1EW5 C14 H25 SING N N 68  
A1EW5 C15 H26 SING N N 69  
A1EW5 C15 H27 SING N N 70  
A1EW5 C16 H28 SING N N 71  
A1EW5 C16 H29 SING N N 72  
A1EW5 C17 H30 SING N N 73  
A1EW5 C17 H31 SING N N 74  
A1EW5 C21 H32 SING N N 75  
A1EW5 C21 H33 SING N N 76  
A1EW5 C22 H34 SING N N 77  
A1EW5 C23 H35 SING N N 78  
A1EW5 C23 H36 SING N N 79  
A1EW5 C28 H37 SING N N 80  
A1EW5 C28 H38 SING N N 81  
A1EW5 C29 H39 SING N N 82  
A1EW5 C29 H40 SING N N 83  
A1EW5 C30 H41 SING N N 84  
A1EW5 C30 H42 SING N N 85  
A1EW5 C31 H43 SING N N 86  
A1EW5 C31 H44 SING N N 87  
A1EW5 C32 H45 SING N N 88  
A1EW5 C32 H46 SING N N 89  
A1EW5 C33 H47 SING N N 90  
A1EW5 C33 H48 SING N N 91  
A1EW5 C34 H49 SING N N 92  
A1EW5 C34 H50 SING N N 93  
A1EW5 C35 H51 SING N N 94  
A1EW5 C36 H52 SING N N 95  
A1EW5 C37 H53 SING N N 96  
A1EW5 C37 H54 SING N N 97  
A1EW5 C38 H55 SING N N 98  
A1EW5 C38 H56 SING N N 99  
A1EW5 C39 H57 SING N N 100 
A1EW5 C39 H58 SING N N 101 
A1EW5 C40 H59 SING N N 102 
A1EW5 C40 H60 SING N N 103 
A1EW5 C41 H61 SING N N 104 
A1EW5 C41 H62 SING N N 105 
A1EW5 C42 H63 SING N N 106 
A1EW5 C42 H64 SING N N 107 
A1EW5 C43 H65 SING N N 108 
A1EW5 C43 H66 SING N N 109 
A1EW5 C44 H67 SING N N 110 
A1EW5 C44 H68 SING N N 111 
A1EW5 C44 H69 SING N N 112 
A1EW5 O24 H70 SING N N 113 
A1EW5 C09 H71 SING N N 114 
A1EW5 C10 H72 SING N N 115 
# 
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 
A1EW5 InChI            InChI                1.06  "InChI=1S/C39H72O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,37,40H,3-16,21-36H2,1-2H3/b19-17-,20-18-/t37-/m0/s1" 
A1EW5 InChIKey         InChI                1.06  AFSHUZFNMVJNKX-LLWMBOQKSA-N                                                                                                                                                                                
A1EW5 SMILES_CANONICAL CACTVS               3.385 "CCCCCCCC\C=C/CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC\C=C/CCCCCCCC"                                                                                                                                           
A1EW5 SMILES           CACTVS               3.385 "CCCCCCCCC=CCCCCCCCC(=O)OC[CH](CO)OC(=O)CCCCCCCC=CCCCCCCCC"                                                                                                                                                
A1EW5 SMILES_CANONICAL "OpenEye OEToolkits" 2.0.7 "CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC/C=C\CCCCCCCC"                                                                                                                                           
A1EW5 SMILES           "OpenEye OEToolkits" 2.0.7 "CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC=CCCCCCCCC"                                                                                                                                                   
# 
_pdbx_chem_comp_identifier.comp_id           A1EW5 
_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})-2-[(~{Z})-octadec-9-enoyl]oxy-3-oxidanyl-propyl] (~{Z})-octadec-9-enoate" 
# 
_pdbx_chem_comp_synonyms.ordinal      1 
_pdbx_chem_comp_synonyms.comp_id      A1EW5 
_pdbx_chem_comp_synonyms.name         1,2-Dioleoyl-sn-glycerol 
_pdbx_chem_comp_synonyms.provenance   PUBCHEM 
_pdbx_chem_comp_synonyms.type         ? 
# 
loop_
_pdbx_chem_comp_audit.comp_id 
_pdbx_chem_comp_audit.action_type 
_pdbx_chem_comp_audit.date 
_pdbx_chem_comp_audit.processing_site 
A1EW5 "Create component" 2025-09-05 PDBC 
A1EW5 "Initial release"  2025-11-05 RCSB 
# 
