data_LPP
# 
_chem_comp.id                                    LPP 
_chem_comp.name                                  "2-(HEXADECANOYLOXY)-1-[(PHOSPHONOOXY)METHYL]ETHYL HEXADECANOATE" 
_chem_comp.type                                  NON-POLYMER 
_chem_comp.pdbx_type                             HETAIN 
_chem_comp.formula                               "C35 H69 O8 P" 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         "1,2-DIPALMITOYL-SN-GLYCERO-3-PHOSPHATE; L-B,G-DIPALMITOYL-A-PHOSPHATIDIC ACID DISODIUM SALT; 3-SN-PHOSPHATIDIC ACID; 1,2-DIPALMITOYLDISODIUM SALT" 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     2000-12-14 
_chem_comp.pdbx_modified_date                    2008-10-14 
_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                        648.891 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     LPP 
_chem_comp.pdbx_model_coordinates_details        ? 
_chem_comp.pdbx_model_coordinates_missing_flag   N 
_chem_comp.pdbx_ideal_coordinates_details        ? 
_chem_comp.pdbx_ideal_coordinates_missing_flag   N 
_chem_comp.pdbx_model_coordinates_db_code        1HG4 
_chem_comp.pdbx_subcomponent_list                ? 
_chem_comp.pdbx_processing_site                  EBI 
# 
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 
LPP P1   P1   P 0 1 N N N 18.973 -17.723 11.616 -4.803 -2.209 0.479   P1   LPP 1   
LPP O2   O2   O 0 1 N N N 18.969 -16.677 12.858 -3.949 -3.231 1.384   O2   LPP 2   
LPP O3   O3   O 0 1 N N N 19.377 -19.149 12.275 -5.073 -2.825 -0.838  O3   LPP 3   
LPP O4   O4   O 0 1 N N N 20.037 -17.230 10.348 -6.198 -1.880 1.213   O4   LPP 4   
LPP O5   O5   O 0 1 N N N 17.422 -17.892 11.117 -3.970 -0.847 0.274   O5   LPP 5   
LPP C6   C6   C 0 1 N N N 16.562 -16.795 11.333 -4.777 0.013  -0.531  C6   LPP 6   
LPP C7   C7   C 0 1 N N R 15.350 -16.888 10.412 -4.039 1.332  -0.765  C7   LPP 7   
LPP C8   C8   C 0 1 N N N 14.163 -16.194 11.089 -3.761 2.006  0.579   C8   LPP 8   
LPP O9   O9   O 0 1 N N N 15.651 -16.206 9.205  -2.782 1.070  -1.444  O9   LPP 9   
LPP O27  O27  O 0 1 N N N 13.094 -16.058 10.189 -2.941 1.132  1.399   O27  LPP 10  
LPP C11  C11  C 0 1 N N N 15.390 -16.944 8.074  -2.732 1.064  -2.785  C11  LPP 11  
LPP O10  O10  O 0 1 N N N 15.314 -18.169 8.009  -3.733 1.277  -3.428  O10  LPP 12  
LPP C12  C12  C 0 1 N N N 15.215 -16.007 6.887  -1.428 0.793  -3.490  C12  LPP 13  
LPP C13  C13  C 0 1 N N N 13.727 -15.738 6.693  -1.646 0.843  -5.003  C13  LPP 14  
LPP C14  C14  C 0 1 N N N 13.440 -15.390 5.244  -0.322 0.567  -5.718  C14  LPP 15  
LPP C15  C15  C 0 1 N N N 13.037 -13.934 5.166  -0.539 0.618  -7.232  C15  LPP 16  
LPP C16  C16  C 0 1 N N N 11.942 -13.762 4.132  0.784  0.342  -7.947  C16  LPP 17  
LPP C17  C17  C 0 1 N N N 11.322 -12.386 4.308  0.566  0.393  -9.461  C17  LPP 18  
LPP C18  C18  C 0 1 N N N 11.037 -11.788 2.944  1.890  0.117  -10.176 C18  LPP 19  
LPP C19  C19  C 0 1 N N N 11.904 -10.553 2.754  1.672  0.168  -11.690 C19  LPP 20  
LPP C20  C20  C 0 1 N N N 11.016 -9.315  2.752  2.996  -0.107 -12.405 C20  LPP 21  
LPP C21  C21  C 0 1 N N N 11.205 -8.534  1.451  2.779  -0.056 -13.918 C21  LPP 22  
LPP C22  C22  C 0 1 N N N 10.330 -9.127  0.349  4.103  -0.332 -14.634 C22  LPP 23  
LPP C23  C23  C 0 1 N N N 9.037  -8.343  0.223  3.885  -0.281 -16.147 C23  LPP 24  
LPP C24  C24  C 0 1 N N N 8.086  -9.136  -0.664 5.209  -0.557 -16.863 C24  LPP 25  
LPP C25  C25  C 0 1 N N N 6.790  -8.362  -0.871 4.991  -0.506 -18.376 C25  LPP 26  
LPP C26  C26  C 0 1 N N N 6.799  -7.678  -2.233 6.315  -0.782 -19.091 C26  LPP 27  
LPP C29  C29  C 0 1 N N N 11.990 -15.572 10.801 -2.570 1.518  2.630   C29  LPP 28  
LPP O28  O28  O 0 1 N N N 11.943 -15.067 11.915 -2.919 2.594  3.056   O28  LPP 29  
LPP C30  C30  C 0 1 N N N 10.801 -15.768 9.862  -1.720 0.611  3.480   C30  LPP 30  
LPP C31  C31  C 0 1 N N N 9.748  -14.682 10.099 -1.442 1.285  4.825   C31  LPP 31  
LPP C32  C32  C 0 1 N N N 9.660  -13.755 8.888  -0.578 0.363  5.689   C32  LPP 32  
LPP C33  C33  C 0 1 N N N 9.912  -12.311 9.329  -0.300 1.038  7.034   C33  LPP 33  
LPP C34  C34  C 0 1 N N N 9.771  -11.377 8.136  0.563  0.116  7.897   C34  LPP 34  
LPP C35  C35  C 0 1 N N N 9.825  -9.927  8.605  0.840  0.790  9.243   C35  LPP 35  
LPP C36  C36  C 0 1 N N N 9.024  -9.050  7.656  1.704  -0.130 10.106  C36  LPP 36  
LPP C37  C37  C 0 1 N N N 9.970  -8.191  6.824  1.982  0.543  11.451  C37  LPP 37  
LPP C38  C38  C 0 1 N N N 9.339  -6.828  6.543  2.846  -0.378 12.315  C38  LPP 38  
LPP C39  C39  C 0 1 N N N 8.969  -6.720  5.068  3.124  0.295  13.660  C39  LPP 39  
LPP C40  C40  C 0 1 N N N 7.472  -6.945  4.910  3.987  -0.625 14.523  C40  LPP 40  
LPP C41  C41  C 0 1 N N N 6.996  -6.387  3.586  4.265  0.048  15.868  C41  LPP 41  
LPP C42  C42  C 0 1 N N N 5.883  -7.279  3.070  5.129  -0.873 16.732  C42  LPP 42  
LPP C43  C43  C 0 1 N N N 5.082  -6.540  2.007  5.407  -0.198 18.077  C43  LPP 43  
LPP C44  C44  C 0 1 N N N 3.836  -7.349  1.642  6.270  -1.120 18.941  C44  LPP 44  
LPP HO2  HO2  H 0 1 N N N 18.732 -15.841 12.472 -4.483 -4.031 1.482   HO2  LPP 45  
LPP HO4  HO4  H 0 1 N N N 20.039 -17.842 9.621  -5.978 -1.481 2.066   HO4  LPP 46  
LPP HC61 1HC6 H 0 0 N N N 16.265 -16.702 12.403 -5.720 0.209  -0.022  HC61 LPP 47  
LPP HC62 2HC6 H 0 0 N N N 17.093 -15.820 11.225 -4.975 -0.467 -1.489  HC62 LPP 48  
LPP HC7  HC7  H 0 1 N N N 15.100 -17.954 10.203 -4.654 1.989  -1.380  HC7  LPP 49  
LPP HC81 1HC8 H 0 0 N N N 13.854 -16.718 12.023 -4.704 2.203  1.089   HC81 LPP 50  
LPP HC82 2HC8 H 0 0 N N N 14.455 -15.215 11.536 -3.235 2.946  0.413   HC82 LPP 51  
LPP H121 1H12 H 0 0 N N N 15.808 -15.068 6.992  -0.696 1.547  -3.202  H121 LPP 52  
LPP H122 2H12 H 0 0 N N N 15.702 -16.394 5.962  -1.062 -0.194 -3.208  H122 LPP 53  
LPP H131 1H13 H 0 0 N N N 13.100 -16.589 7.048  -2.378 0.089  -5.290  H131 LPP 54  
LPP H132 2H13 H 0 0 N N N 13.351 -14.954 7.391  -2.012 1.831  -5.285  H132 LPP 55  
LPP H141 1H14 H 0 0 N N N 14.294 -15.633 4.569  0.410  1.322  -5.431  H141 LPP 56  
LPP H142 2H14 H 0 0 N N N 12.683 -16.067 4.784  0.043  -0.419 -5.437  H142 LPP 57  
LPP H151 1H15 H 0 0 N N N 12.743 -13.525 6.161  -1.272 -0.135 -7.519  H151 LPP 58  
LPP H152 2H15 H 0 0 N N N 13.908 -13.266 4.969  -0.906 1.606  -7.513  H152 LPP 59  
LPP H161 1H16 H 0 0 N N N 12.304 -13.937 3.092  1.516  1.097  -7.660  H161 LPP 60  
LPP H162 2H16 H 0 0 N N N 11.185 -14.580 4.170  1.150  -0.644 -7.666  H162 LPP 61  
LPP H171 1H17 H 0 0 N N N 10.415 -12.410 4.956  -0.165 -0.360 -9.748  H171 LPP 62  
LPP H172 2H17 H 0 0 N N N 11.950 -11.716 4.940  0.200  1.381  -9.742  H172 LPP 63  
LPP H181 1H18 H 0 0 N N N 11.166 -12.528 2.120  2.622  0.872  -9.889  H181 LPP 64  
LPP H182 2H18 H 0 0 N N N 9.953  -11.573 2.792  2.256  -0.869 -9.895  H182 LPP 65  
LPP H191 1H19 H 0 0 N N N 12.720 -10.487 3.510  0.940  -0.586 -11.977 H191 LPP 66  
LPP H192 2H19 H 0 0 N N N 12.541 -10.618 1.841  1.306  1.155  -11.971 H192 LPP 67  
LPP H201 1H20 H 0 0 N N N 9.945  -9.569  2.934  3.729  0.647  -12.118 H201 LPP 68  
LPP H202 2H20 H 0 0 N N N 11.187 -8.677  3.650  3.362  -1.094 -12.123 H202 LPP 69  
LPP H211 1H21 H 0 0 N N N 11.019 -7.443  1.589  2.046  -0.811 -14.206 H211 LPP 70  
LPP H212 2H21 H 0 0 N N N 12.276 -8.480  1.148  2.413  0.930  -14.200 H212 LPP 71  
LPP H221 1H22 H 0 0 N N N 10.872 -9.192  -0.622 4.835  0.422  -14.346 H221 LPP 72  
LPP H222 2H22 H 0 0 N N N 10.142 -10.214 0.507  4.469  -1.319 -14.352 H222 LPP 73  
LPP H231 1H23 H 0 0 N N N 8.590  -8.087  1.212  3.153  -1.036 -16.435 H231 LPP 74  
LPP H232 2H23 H 0 0 N N N 9.198  -7.302  -0.142 3.519  0.705  -16.429 H232 LPP 75  
LPP H241 1H24 H 0 0 N N N 8.559  -9.421  -1.632 5.941  0.197  -16.575 H241 LPP 76  
LPP H242 2H24 H 0 0 N N N 7.900  -10.160 -0.264 5.575  -1.544 -16.581 H242 LPP 77  
LPP H251 1H25 H 0 0 N N N 5.891  -9.008  -0.735 4.259  -1.261 -18.663 H251 LPP 78  
LPP H252 2H25 H 0 0 N N N 6.598  -7.640  -0.043 4.625  0.480  -18.658 H252 LPP 79  
LPP H261 1H26 H 0 0 N N N 5.850  -7.111  -2.384 6.160  -0.746 -20.170 H261 LPP 80  
LPP H262 2H26 H 0 0 N N N 7.697  -7.031  -2.368 7.048  -0.028 -18.804 H262 LPP 81  
LPP H263 3H26 H 0 0 N N N 6.990  -8.400  -3.060 6.682  -1.770 -18.810 H263 LPP 82  
LPP H301 1H30 H 0 0 N N N 11.118 -15.812 8.794  -0.776 0.414  2.971   H301 LPP 83  
LPP H302 2H30 H 0 0 N N N 10.368 -16.791 9.948  -2.245 -0.328 3.647   H302 LPP 84  
LPP H311 1H31 H 0 0 N N N 8.755  -15.115 10.363 -2.385 1.481  5.335   H311 LPP 85  
LPP H312 2H31 H 0 0 N N N 9.937  -14.117 11.041 -0.916 2.225  4.659   H312 LPP 86  
LPP H321 1H32 H 0 0 N N N 10.344 -14.069 8.066  0.364  0.167  5.179   H321 LPP 87  
LPP H322 2H32 H 0 0 N N N 8.694  -13.866 8.342  -1.104 -0.576 5.855   H322 LPP 88  
LPP H331 1H33 H 0 0 N N N 9.253  -12.010 10.177 -1.244 1.234  7.543   H331 LPP 89  
LPP H332 2H33 H 0 0 N N N 10.896 -12.193 9.839  0.225  1.978  6.867   H332 LPP 90  
LPP H341 1H34 H 0 0 N N N 10.527 -11.590 7.345  1.506  -0.080 7.388   H341 LPP 91  
LPP H342 2H34 H 0 0 N N N 8.851  -11.591 7.542  0.037  -0.823 8.064   H342 LPP 92  
LPP H351 1H35 H 0 0 N N N 9.490  -9.815  9.662  -0.102 0.987  9.752   H351 LPP 93  
LPP H352 2H35 H 0 0 N N N 10.872 -9.564  8.728  1.366  1.730  9.076   H352 LPP 94  
LPP H361 1H36 H 0 0 N N N 8.329  -9.646  7.019  2.647  -0.327 9.597   H361 LPP 95  
LPP H362 2H36 H 0 0 N N N 8.263  -8.436  8.193  1.178  -1.071 10.273  H362 LPP 96  
LPP H371 1H37 H 0 0 N N N 10.973 -8.094  7.301  1.039  0.739  11.961  H371 LPP 97  
LPP H372 2H37 H 0 0 N N N 10.283 -8.705  5.885  2.508  1.483  11.285  H372 LPP 98  
LPP H381 1H38 H 0 0 N N N 8.467  -6.625  7.208  3.789  -0.574 11.805  H381 LPP 99  
LPP H382 2H38 H 0 0 N N N 9.994  -5.988  6.872  2.320  -1.318 12.481  H382 LPP 100 
LPP H391 1H39 H 0 0 N N N 9.302  -5.756  4.617  2.180  0.492  14.169  H391 LPP 101 
LPP H392 2H39 H 0 0 N N N 9.570  -7.408  4.429  3.649  1.236  13.493  H392 LPP 102 
LPP H401 1H40 H 0 0 N N N 7.197  -8.018  5.032  4.931  -0.822 14.014  H401 LPP 103 
LPP H402 2H40 H 0 0 N N N 6.895  -6.528  5.768  3.461  -1.565 14.690  H402 LPP 104 
LPP H411 1H41 H 0 0 N N N 6.692  -5.316  3.654  3.322  0.245  16.378  H411 LPP 105 
LPP H412 2H41 H 0 0 N N N 7.823  -6.261  2.849  4.791  0.988  15.702  H412 LPP 106 
LPP H421 1H42 H 0 0 N N N 6.267  -8.258  2.700  6.072  -1.069 16.222  H421 LPP 107 
LPP H422 2H42 H 0 0 N N N 5.235  -7.660  3.893  4.603  -1.813 16.899  H422 LPP 108 
LPP H431 1H43 H 0 0 N N N 4.829  -5.499  2.319  4.463  -0.002 18.587  H431 LPP 109 
LPP H432 2H43 H 0 0 N N N 5.699  -6.294  1.111  5.932  0.741  17.911  H432 LPP 110 
LPP H441 1H44 H 0 0 N N N 3.249  -6.807  0.863  6.468  -0.640 19.899  H441 LPP 111 
LPP H442 2H44 H 0 0 N N N 4.088  -8.389  1.329  5.745  -2.060 19.107  H442 LPP 112 
LPP H443 3H44 H 0 0 N N N 3.218  -7.594  2.537  7.214  -1.316 18.431  H443 LPP 113 
# 
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 
LPP P1  O2   SING N N 1   
LPP P1  O3   DOUB N N 2   
LPP P1  O4   SING N N 3   
LPP P1  O5   SING N N 4   
LPP O2  HO2  SING N N 5   
LPP O4  HO4  SING N N 6   
LPP O5  C6   SING N N 7   
LPP C6  C7   SING N N 8   
LPP C6  HC61 SING N N 9   
LPP C6  HC62 SING N N 10  
LPP C7  C8   SING N N 11  
LPP C7  O9   SING N N 12  
LPP C7  HC7  SING N N 13  
LPP C8  O27  SING N N 14  
LPP C8  HC81 SING N N 15  
LPP C8  HC82 SING N N 16  
LPP O9  C11  SING N N 17  
LPP O27 C29  SING N N 18  
LPP C11 O10  DOUB N N 19  
LPP C11 C12  SING N N 20  
LPP C12 C13  SING N N 21  
LPP C12 H121 SING N N 22  
LPP C12 H122 SING N N 23  
LPP C13 C14  SING N N 24  
LPP C13 H131 SING N N 25  
LPP C13 H132 SING N N 26  
LPP C14 C15  SING N N 27  
LPP C14 H141 SING N N 28  
LPP C14 H142 SING N N 29  
LPP C15 C16  SING N N 30  
LPP C15 H151 SING N N 31  
LPP C15 H152 SING N N 32  
LPP C16 C17  SING N N 33  
LPP C16 H161 SING N N 34  
LPP C16 H162 SING N N 35  
LPP C17 C18  SING N N 36  
LPP C17 H171 SING N N 37  
LPP C17 H172 SING N N 38  
LPP C18 C19  SING N N 39  
LPP C18 H181 SING N N 40  
LPP C18 H182 SING N N 41  
LPP C19 C20  SING N N 42  
LPP C19 H191 SING N N 43  
LPP C19 H192 SING N N 44  
LPP C20 C21  SING N N 45  
LPP C20 H201 SING N N 46  
LPP C20 H202 SING N N 47  
LPP C21 C22  SING N N 48  
LPP C21 H211 SING N N 49  
LPP C21 H212 SING N N 50  
LPP C22 C23  SING N N 51  
LPP C22 H221 SING N N 52  
LPP C22 H222 SING N N 53  
LPP C23 C24  SING N N 54  
LPP C23 H231 SING N N 55  
LPP C23 H232 SING N N 56  
LPP C24 C25  SING N N 57  
LPP C24 H241 SING N N 58  
LPP C24 H242 SING N N 59  
LPP C25 C26  SING N N 60  
LPP C25 H251 SING N N 61  
LPP C25 H252 SING N N 62  
LPP C26 H261 SING N N 63  
LPP C26 H262 SING N N 64  
LPP C26 H263 SING N N 65  
LPP C29 O28  DOUB N N 66  
LPP C29 C30  SING N N 67  
LPP C30 C31  SING N N 68  
LPP C30 H301 SING N N 69  
LPP C30 H302 SING N N 70  
LPP C31 C32  SING N N 71  
LPP C31 H311 SING N N 72  
LPP C31 H312 SING N N 73  
LPP C32 C33  SING N N 74  
LPP C32 H321 SING N N 75  
LPP C32 H322 SING N N 76  
LPP C33 C34  SING N N 77  
LPP C33 H331 SING N N 78  
LPP C33 H332 SING N N 79  
LPP C34 C35  SING N N 80  
LPP C34 H341 SING N N 81  
LPP C34 H342 SING N N 82  
LPP C35 C36  SING N N 83  
LPP C35 H351 SING N N 84  
LPP C35 H352 SING N N 85  
LPP C36 C37  SING N N 86  
LPP C36 H361 SING N N 87  
LPP C36 H362 SING N N 88  
LPP C37 C38  SING N N 89  
LPP C37 H371 SING N N 90  
LPP C37 H372 SING N N 91  
LPP C38 C39  SING N N 92  
LPP C38 H381 SING N N 93  
LPP C38 H382 SING N N 94  
LPP C39 C40  SING N N 95  
LPP C39 H391 SING N N 96  
LPP C39 H392 SING N N 97  
LPP C40 C41  SING N N 98  
LPP C40 H401 SING N N 99  
LPP C40 H402 SING N N 100 
LPP C41 C42  SING N N 101 
LPP C41 H411 SING N N 102 
LPP C41 H412 SING N N 103 
LPP C42 C43  SING N N 104 
LPP C42 H421 SING N N 105 
LPP C42 H422 SING N N 106 
LPP C43 C44  SING N N 107 
LPP C43 H431 SING N N 108 
LPP C43 H432 SING N N 109 
LPP C44 H441 SING N N 110 
LPP C44 H442 SING N N 111 
LPP C44 H443 SING N N 112 
# 
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 
LPP SMILES           ACDLabs              10.04 O=P(O)(OCC(OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)O                                                                                                                                          
LPP InChI            InChI                1.02b InChI=1/C35H69O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(36)41-31-33(32-42-44(38,39)40)43-35(37)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33H,3-32H2,1-2H3,(H2,38,39,40)/t33-/m1/s1/f/h38-39H 
LPP InChIKey         InChI                1.02b PORPENFLTBBHSG-WBXZXEGJDX                                                                                                                                                                          
LPP SMILES_CANONICAL CACTVS               3.341 CCCCCCCCCCCCCCCC(=O)OC[C@H](CO[P](O)(O)=O)OC(=O)CCCCCCCCCCCCCCC                                                                                                                                    
LPP SMILES           CACTVS               3.341 CCCCCCCCCCCCCCCC(=O)OC[CH](CO[P](O)(O)=O)OC(=O)CCCCCCCCCCCCCCC                                                                                                                                     
LPP SMILES_CANONICAL "OpenEye OEToolkits" 1.5.0 CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCCCCCCCCCC                                                                                                                                      
LPP SMILES           "OpenEye OEToolkits" 1.5.0 CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCCCCCCCCCCCCC                                                                                                                                          
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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 
LPP "SYSTEMATIC NAME" ACDLabs              10.04 "(2R)-3-(phosphonooxy)propane-1,2-diyl dihexadecanoate"        
LPP "SYSTEMATIC NAME" "OpenEye OEToolkits" 1.5.0 "[(2R)-2-hexadecanoyloxy-3-phosphonooxy-propyl] hexadecanoate" 
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