data_C9V # _chem_comp.id C9V _chem_comp.name ;[(2R,5R,11R,14S,24E)-14-[(acetyloxy)methyl]-8-{[5-(3,5-dimethyl-1H-pyrrol-2-yl-kappaN)-5-(3,5-dimethyl-2H-pyrrol-2-ylidene-kappaN)pentanoyl]oxy}-5,11-dihydroxy-2-{[(9E)-octadec-9-enoyl]oxy}-5,11,16-trioxo-4,6,10,12,15-pentaoxa-5lambda~5~,11lambda~5~-diphosphatritriacont-24-en-1-yl (9E)-octadec-9-enoatato](difluoro)boron ; _chem_comp.type NON-POLYMER _chem_comp.pdbx_type HETAIN _chem_comp.formula "C82 H139 B F2 N2 O18 P2" _chem_comp.mon_nstd_parent_comp_id ? _chem_comp.pdbx_synonyms ? _chem_comp.pdbx_formal_charge 0 _chem_comp.pdbx_initial_date 2017-09-20 _chem_comp.pdbx_modified_date 2018-03-02 _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 1551.739 _chem_comp.one_letter_code ? _chem_comp.three_letter_code C9V _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 6B21 _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 C9V CA2 C1 C 0 1 N N N 6.215 44.785 65.219 -2.890 -8.251 1.372 CA2 C9V 1 C9V OA5 O1 O 0 1 N N N 15.131 36.653 63.496 9.718 -2.071 -0.109 OA5 C9V 2 C9V CA3 C2 C 0 1 N N N 7.356 44.509 66.210 -2.705 -6.760 1.490 CA3 C9V 3 C9V CA4 C3 C 0 1 N N N 6.148 44.484 63.831 -1.901 -9.235 1.535 CA4 C9V 4 C9V OA7 O2 O 0 1 N N N 16.672 35.398 62.281 11.621 -1.630 0.923 OA7 C9V 5 C9V C18 C4 C 0 1 N N N 12.324 38.904 61.286 5.598 -3.261 2.739 C18 C9V 6 C9V C19 C5 C 0 1 N N N 13.503 39.456 62.086 7.086 -3.501 2.747 C19 C9V 7 C9V C22 C6 C 0 1 N N N 15.263 39.039 63.673 9.219 -3.632 1.692 C22 C9V 8 C9V C23 C7 C 0 1 N N S 15.830 37.706 64.162 9.847 -3.455 0.308 C23 C9V 9 C9V C24 C8 C 0 1 N N N 15.637 37.511 65.739 9.129 -4.360 -0.696 C24 C9V 10 C9V CA6 C9 C 0 1 N N N 15.757 36.198 62.252 10.666 -1.217 0.310 CA6 C9V 11 C9V C31 C10 C 0 1 N N R 10.459 39.542 66.556 2.855 -3.728 -1.761 C31 C9V 12 C9V C32 C11 C 0 1 N N N 9.405 38.860 67.482 3.114 -2.224 -1.650 C32 C9V 13 C9V C38 C12 C 0 1 N N N 7.007 39.473 70.169 -0.132 1.796 -0.573 C38 C9V 14 C9V C39 C13 C 0 1 N N R 5.570 39.596 69.656 -1.632 1.829 -0.273 C39 C9V 15 C9V C40 C14 C 0 1 N N N 5.439 40.741 68.629 -2.066 3.271 -0.001 C40 C9V 16 C9V C42 C15 C 0 1 N N N 4.891 40.670 66.278 -4.001 4.486 0.676 C42 C9V 17 C9V C44 C16 C 0 1 N N N 4.627 39.636 65.150 -5.445 4.583 1.098 C44 C9V 18 C9V C45 C17 C 0 1 N N N 4.060 40.298 63.887 -5.805 6.049 1.351 C45 C9V 19 C9V C46 C18 C 0 1 N N N 4.429 39.511 62.625 -7.270 6.147 1.780 C46 C9V 20 C9V C47 C19 C 0 1 N N N 4.143 40.290 61.328 -7.630 7.613 2.033 C47 C9V 21 C9V C51 C20 C 0 1 N N N 1.230 40.576 57.996 -11.276 10.719 3.392 C51 C9V 22 C9V C52 C21 C 0 1 N N N 0.496 41.138 56.963 -12.291 11.261 2.766 C52 C9V 23 C9V C53 C22 C 0 1 N N N 0.957 40.895 55.509 -12.646 12.704 3.015 C53 C9V 24 C9V C54 C23 C 0 1 N N N 0.017 41.574 54.484 -12.676 13.459 1.685 C54 C9V 25 C9V C55 C24 C 0 1 N N N -1.444 41.802 54.998 -13.036 14.924 1.938 C55 C9V 26 C9V C56 C25 C 0 1 N N N -2.446 41.758 53.840 -13.066 15.679 0.607 C56 C9V 27 C9V C57 C26 C 0 1 N N N -3.834 42.326 54.202 -13.426 17.145 0.860 C57 C9V 28 C9V C58 C27 C 0 1 N N N -3.792 43.845 54.500 -13.456 17.899 -0.471 C58 C9V 29 C9V C59 C28 C 0 1 N N N -5.012 44.605 53.917 -13.816 19.365 -0.218 C59 C9V 30 C9V C60 C29 C 0 1 N N N -6.286 44.421 54.757 -13.846 20.119 -1.548 C60 C9V 31 C9V C62 C30 C 0 1 N N N 5.321 37.152 69.763 -3.532 0.695 -1.159 C62 C9V 32 C9V C64 C31 C 0 1 N N N 4.170 36.562 70.590 -4.348 0.130 -2.293 C64 C9V 33 C9V C65 C32 C 0 1 N N N 3.682 37.439 71.762 -5.620 -0.511 -1.734 C65 C9V 34 C9V C66 C33 C 0 1 N N N 2.369 38.156 71.440 -6.450 -1.085 -2.885 C66 C9V 35 C9V C67 C34 C 0 1 N N N 1.166 37.487 72.082 -7.721 -1.726 -2.327 C67 C9V 36 C9V C71 C35 C 0 1 N N N -1.418 38.454 67.972 -11.905 -4.147 -3.521 C71 C9V 37 C9V C72 C36 C 0 1 N N N -1.229 38.887 66.674 -13.078 -3.772 -3.968 C72 C9V 38 C9V C73 C37 C 0 1 N N N -2.443 38.983 65.688 -14.330 -4.405 -3.419 C73 C9V 39 C9V C74 C38 C 0 1 N N N -2.000 39.699 64.403 -15.266 -3.312 -2.897 C74 C9V 40 C9V C75 C39 C 0 1 N N N -3.191 39.934 63.433 -16.538 -3.954 -2.339 C75 C9V 41 C9V C76 C40 C 0 1 N N N -2.756 40.465 62.054 -17.473 -2.862 -1.816 C76 C9V 42 C9V C77 C41 C 0 1 N N N -3.863 40.206 60.982 -18.745 -3.503 -1.258 C77 C9V 43 C9V C78 C42 C 0 1 N N N -3.315 40.193 59.534 -19.681 -2.411 -0.736 C78 C9V 44 C9V C79 C43 C 0 1 N N N -4.441 40.202 58.500 -20.952 -3.053 -0.178 C79 C9V 45 C9V C80 C44 C 0 1 N N N -3.949 39.800 57.093 -21.888 -1.960 0.344 C80 C9V 46 C9V C82 C45 C 0 1 N N N 9.633 39.918 64.265 1.800 -5.382 -0.407 C82 C9V 47 C9V C84 C46 C 0 1 N N N 8.156 40.387 64.528 1.339 -5.932 0.918 C84 C9V 48 C9V C85 C47 C 0 1 N N N 7.596 41.264 63.404 0.627 -7.268 0.696 C85 C9V 49 C9V C86 C48 C 0 1 N N N 8.163 42.754 63.449 0.054 -7.768 2.023 C86 C9V 50 C9V C87 C49 C 0 1 N N N 7.109 43.791 62.851 -0.541 -9.139 1.829 C87 C9V 51 C9V O20 O3 O 0 1 N N N 14.117 40.419 61.672 7.645 -3.797 3.777 O20 C9V 52 C9V O21 O4 O 0 1 N N N 13.885 38.841 63.318 7.790 -3.387 1.610 O21 C9V 53 C9V O25 O5 O 0 1 N N N 14.427 36.717 65.962 7.730 -4.068 -0.685 O25 C9V 54 C9V P26 P1 P 0 1 N N N 13.449 37.104 67.252 6.685 -4.749 -1.702 P26 C9V 55 C9V O27 O6 O 0 1 N N N 14.183 38.047 68.177 6.613 -6.332 -1.419 O27 C9V 56 C9V O28 O7 O 0 1 N N N 13.085 35.853 67.997 7.129 -4.517 -3.095 O28 C9V 57 C9V O29 O8 O 0 1 N N N 12.125 37.795 66.719 5.227 -4.099 -1.488 O29 C9V 58 C9V C30 C50 C 0 1 N N N 11.909 39.208 66.982 4.103 -4.422 -2.310 C30 C9V 59 C9V O33 O9 O 0 1 N N N 9.548 39.416 68.809 1.913 -1.562 -1.248 O33 C9V 60 C9V P34 P2 P 0 1 N N N 8.960 40.888 69.112 1.820 0.030 -1.032 P34 C9V 61 C9V O35 O10 O 0 1 N N N 10.002 41.705 69.822 2.761 0.460 0.201 O35 C9V 62 C9V O36 O11 O 0 1 N N N 8.578 41.575 67.799 2.269 0.722 -2.260 O36 C9V 63 C9V O37 O12 O 0 1 N N N 7.645 40.761 70.052 0.296 0.440 -0.712 O37 C9V 64 C9V O41 O13 O 0 1 N N N 4.441 40.404 67.644 -3.462 3.289 0.400 O41 C9V 65 C9V O43 O14 O 0 1 N N N 5.482 41.711 66.021 -3.330 5.487 0.587 O43 C9V 66 C9V C48 C51 C 0 1 N N N 2.700 40.863 61.248 -9.096 7.711 2.461 C48 C9V 67 C9V C49 C52 C 0 1 N N N 1.764 39.968 60.405 -9.456 9.177 2.714 C49 C9V 68 C9V C50 C53 C 0 1 N N N 0.810 40.787 59.470 -10.921 9.275 3.143 C50 C9V 69 C9V O61 O15 O 0 1 N N N 5.159 38.371 69.020 -2.366 1.310 -1.413 O61 C9V 70 C9V O63 O16 O 0 1 N N N 6.381 36.543 69.720 -3.926 0.595 -0.021 O63 C9V 71 C9V C68 C54 C 0 1 N N N 0.135 36.960 71.029 -8.551 -2.300 -3.478 C68 C9V 72 C9V C69 C55 C 0 1 N N N -0.675 38.115 70.363 -9.823 -2.941 -2.920 C69 C9V 73 C9V C70 C56 C 0 1 N N N -0.213 38.374 68.912 -10.652 -3.515 -4.071 C70 C9V 74 C9V O81 O17 O 0 1 N N N 10.282 39.005 65.202 2.541 -4.264 -0.448 O81 C9V 75 C9V O83 O18 O 0 1 N N N 10.227 40.300 63.291 1.503 -5.948 -1.433 O83 C9V 76 C9V C88 C57 C 0 1 Y N N 6.692 43.632 61.359 0.296 -10.247 1.953 C88 C9V 77 C9V C89 C58 C 0 1 Y N N 7.347 43.046 60.224 1.668 -10.351 2.241 C89 C9V 78 C9V C90 C59 C 0 1 N N N 8.737 42.391 60.132 2.621 -9.213 2.501 C90 C9V 79 C9V C91 C60 C 0 1 Y N N 6.470 43.185 59.140 1.972 -11.700 2.240 C91 C9V 80 C9V C92 C61 C 0 1 Y N N 5.317 43.829 59.613 0.805 -12.387 1.957 C92 C9V 81 C9V C93 C62 C 0 1 N N N 4.086 44.188 58.772 0.676 -13.885 1.857 C93 C9V 82 C9V N94 N1 N 0 1 Y N N 5.486 44.077 60.949 -0.182 -11.516 1.789 N94 C9V 83 C9V B95 B1 B -1 1 N N N 4.524 44.760 61.928 -1.652 -11.700 1.466 B95 C9V 84 C9V F96 F1 F 0 1 N N N 4.207 46.281 61.326 -1.739 -12.383 0.281 F96 C9V 85 C9V F97 F2 F 0 1 N N N 3.087 43.918 61.912 -2.202 -12.488 2.442 F97 C9V 86 C9V N98 N2 N 1 1 N N N 4.942 44.925 63.393 -2.500 -10.449 1.348 N98 C9V 87 C9V C99 C63 C 0 1 N N N 4.245 45.492 64.412 -3.787 -10.271 1.082 C99 C9V 88 C9V CA0 C64 C 0 1 N N N 2.842 46.111 64.309 -4.784 -11.369 0.813 CA0 C9V 89 C9V CA1 C65 C 0 1 N N N 5.020 45.421 65.572 -4.068 -8.917 1.088 CA1 C9V 90 C9V CA8 C66 C 0 1 N N N 15.244 36.753 60.885 10.538 0.255 0.014 CA8 C9V 91 C9V CA9 C67 C 0 1 N N N 14.860 35.620 59.880 11.800 0.981 0.484 CA9 C9V 92 C9V CAA C68 C 0 1 N N N 16.044 35.217 58.954 11.621 2.489 0.296 CAA C9V 93 C9V CAB C69 C 0 1 N N N 15.520 34.744 57.569 12.926 3.205 0.649 CAB C9V 94 C9V CAC C70 C 0 1 N N N 16.605 34.027 56.692 12.747 4.713 0.461 CAC C9V 95 C9V CAD C71 C 0 1 N N N 16.175 33.959 55.187 14.052 5.429 0.814 CAD C9V 96 C9V CAE C72 C 0 1 N N N 14.670 33.754 55.032 13.873 6.937 0.626 CAE C9V 97 C9V CAF C73 C 0 1 N N N 14.013 35.074 54.495 15.158 7.643 0.974 CAF C9V 98 C9V CAG C74 C 0 1 N N N 12.672 35.108 54.174 15.722 8.445 0.105 CAG C9V 99 C9V CAH C75 C 0 1 N N N 12.050 36.437 53.643 17.007 9.150 0.454 CAH C9V 100 C9V CAI C76 C 0 1 N N N 10.728 36.735 54.355 18.062 8.843 -0.611 CAI C9V 101 C9V CAJ C77 C 0 1 N N N 10.147 38.120 53.924 19.367 9.559 -0.257 CAJ C9V 102 C9V CAK C78 C 0 1 N N N 9.403 38.849 55.095 20.423 9.252 -1.321 CAK C9V 103 C9V CAL C79 C 0 1 N N N 8.403 37.919 55.825 21.728 9.968 -0.967 CAL C9V 104 C9V CAM C80 C 0 1 N N N 7.287 38.749 56.585 22.783 9.660 -2.031 CAM C9V 105 C9V CAN C81 C 0 1 N N N 7.391 38.565 58.125 24.088 10.377 -1.677 CAN C9V 106 C9V CAO C82 C 0 1 N N N 6.616 39.664 58.885 25.143 10.069 -2.741 CAO C9V 107 C9V H1 H1 H 0 1 N N N 7.072 44.875 67.208 -3.658 -6.261 1.314 H1 C9V 108 C9V H2 H2 H 0 1 N N N 7.547 43.427 66.257 -2.346 -6.517 2.490 H2 C9V 109 C9V H3 H3 H 0 1 N N N 8.266 45.028 65.875 -1.978 -6.425 0.750 H3 C9V 110 C9V H4 H4 H 0 1 N N N 12.186 39.504 60.375 5.080 -4.199 2.538 H4 C9V 111 C9V H5 H5 H 0 1 N N N 12.526 37.859 61.009 5.287 -2.875 3.710 H5 C9V 112 C9V H6 H6 H 0 1 N N N 11.411 38.951 61.898 5.351 -2.536 1.964 H6 C9V 113 C9V H7 H7 H 0 1 N N N 15.828 39.383 62.794 9.393 -4.649 2.043 H7 C9V 114 C9V H8 H8 H 0 1 N N N 15.337 39.790 64.473 9.669 -2.924 2.388 H8 C9V 115 C9V H9 H9 H 0 1 N N N 16.906 37.663 63.936 10.902 -3.725 0.351 H9 C9V 116 C9V H10 H10 H 0 1 N N N 16.508 36.986 66.158 9.529 -4.183 -1.695 H10 C9V 117 C9V H11 H11 H 0 1 N N N 15.532 38.492 66.225 9.285 -5.403 -0.422 H11 C9V 118 C9V H12 H12 H 0 1 N N N 10.310 40.632 66.568 2.016 -3.903 -2.434 H12 C9V 119 C9V H13 H13 H 0 1 N N N 8.392 39.057 67.102 3.893 -2.044 -0.909 H13 C9V 120 C9V H14 H14 H 0 1 N N N 9.581 37.775 67.511 3.435 -1.839 -2.617 H14 C9V 121 C9V H15 H15 H 0 1 N N N 6.999 39.157 71.223 0.065 2.336 -1.499 H15 C9V 122 C9V H16 H16 H 0 1 N N N 7.554 38.732 69.568 0.412 2.267 0.245 H16 C9V 123 C9V H17 H17 H 0 1 N N N 4.910 39.815 70.508 -1.841 1.216 0.604 H17 C9V 124 C9V H18 H18 H 0 1 N N N 6.407 40.896 68.130 -1.454 3.691 0.797 H18 C9V 125 C9V H19 H19 H 0 1 N N N 5.142 41.664 69.148 -1.941 3.865 -0.906 H19 C9V 126 C9V H20 H20 H 0 1 N N N 3.906 38.889 65.514 -6.082 4.184 0.309 H20 C9V 127 C9V H21 H21 H 0 1 N N N 5.574 39.138 64.896 -5.595 4.009 2.013 H21 C9V 128 C9V H22 H22 H 0 1 N N N 4.467 41.317 63.804 -5.168 6.449 2.140 H22 C9V 129 C9V H23 H23 H 0 1 N N N 2.964 40.346 63.970 -5.654 6.623 0.437 H23 C9V 130 C9V H24 H24 H 0 1 N N N 3.846 38.578 62.610 -7.907 5.748 0.991 H24 C9V 131 C9V H25 H25 H 0 1 N N N 5.502 39.272 62.662 -7.421 5.573 2.694 H25 C9V 132 C9V H26 H26 H 0 1 N N N 4.295 39.612 60.475 -6.993 8.012 2.822 H26 C9V 133 C9V H27 H27 H 0 1 N N N 4.853 41.127 61.262 -7.480 8.187 1.118 H27 C9V 134 C9V H28 H28 H 0 1 N N N 2.105 39.984 57.769 -10.693 11.306 4.086 H28 C9V 135 C9V H29 H29 H 0 1 N N N -0.381 41.734 57.171 -12.873 10.674 2.072 H29 C9V 136 C9V H30 H30 H 0 1 N N N 0.970 39.812 55.316 -13.626 12.761 3.487 H30 C9V 137 C9V H31 H31 H 0 1 N N N 1.971 41.302 55.385 -11.900 13.154 3.671 H31 C9V 138 C9V H32 H32 H 0 1 N N N -0.029 40.940 53.587 -11.695 13.402 1.212 H32 C9V 139 C9V H33 H33 H 0 1 N N N 0.445 42.552 54.220 -13.421 13.010 1.029 H33 C9V 140 C9V H34 H34 H 0 1 N N N -1.504 42.785 55.488 -14.016 14.981 2.410 H34 C9V 141 C9V H35 H35 H 0 1 N N N -1.697 41.015 55.723 -12.290 15.374 2.593 H35 C9V 142 C9V H36 H36 H 0 1 N N N -2.570 40.711 53.527 -12.085 15.622 0.135 H36 C9V 143 C9V H37 H37 H 0 1 N N N -2.037 42.345 53.004 -13.812 15.230 -0.049 H37 C9V 144 C9V H38 H38 H 0 1 N N N -4.518 42.150 53.359 -14.407 17.201 1.332 H38 C9V 145 C9V H39 H39 H 0 1 N N N -4.209 41.802 55.093 -12.680 17.594 1.516 H39 C9V 146 C9V H40 H40 H 0 1 N N N -2.874 44.264 54.062 -12.476 17.842 -0.943 H40 C9V 147 C9V H41 H41 H 0 1 N N N -3.776 43.989 55.590 -14.202 17.450 -1.126 H41 C9V 148 C9V H42 H42 H 0 1 N N N -4.771 45.677 53.875 -14.797 19.421 0.255 H42 C9V 149 C9V H43 H43 H 0 1 N N N -5.205 44.233 52.900 -13.071 19.814 0.438 H43 C9V 150 C9V H44 H44 H 0 1 N N N -7.114 44.980 54.296 -14.103 21.163 -1.368 H44 C9V 151 C9V H45 H45 H 0 1 N N N -6.545 43.353 54.801 -12.866 20.062 -2.021 H45 C9V 152 C9V H46 H46 H 0 1 N N N -6.111 44.798 55.776 -14.592 19.670 -2.204 H46 C9V 153 C9V H47 H47 H 0 1 N N N 3.318 36.393 69.915 -4.618 0.932 -2.981 H47 C9V 154 C9V H48 H48 H 0 1 N N N 4.507 35.600 71.003 -3.764 -0.622 -2.822 H48 C9V 155 C9V H49 H49 H 0 1 N N N 3.529 36.799 72.644 -5.351 -1.313 -1.046 H49 C9V 156 C9V H50 H50 H 0 1 N N N 4.452 38.193 71.985 -6.205 0.241 -1.205 H50 C9V 157 C9V H51 H51 H 0 1 N N N 2.434 39.191 71.806 -6.719 -0.283 -3.574 H51 C9V 158 C9V H52 H52 H 0 1 N N N 2.229 38.161 70.349 -5.865 -1.837 -3.415 H52 C9V 159 C9V H53 H53 H 0 1 N N N 0.663 38.217 72.732 -7.452 -2.528 -1.639 H53 C9V 160 C9V H54 H54 H 0 1 N N N 1.517 36.638 72.687 -8.306 -0.974 -1.798 H54 C9V 161 C9V H55 H55 H 0 1 N N N -2.402 38.176 68.319 -11.835 -4.908 -2.759 H55 C9V 162 C9V H56 H56 H 0 1 N N N -0.240 39.161 66.337 -13.147 -3.011 -4.731 H56 C9V 163 C9V H57 H57 H 0 1 N N N -3.257 39.550 66.162 -14.831 -4.965 -4.208 H57 C9V 164 C9V H58 H58 H 0 1 N N N -2.797 37.971 65.441 -14.069 -5.079 -2.604 H58 C9V 165 C9V H59 H59 H 0 1 N N N -1.243 39.083 63.895 -14.765 -2.752 -2.107 H59 C9V 166 C9V H60 H60 H 0 1 N N N -1.562 40.672 64.671 -15.527 -2.637 -3.712 H60 C9V 167 C9V H61 H61 H 0 1 N N N -3.874 40.665 63.889 -17.038 -4.514 -3.128 H61 C9V 168 C9V H62 H62 H 0 1 N N N -3.718 38.979 63.289 -16.277 -4.629 -1.523 H62 C9V 169 C9V H63 H63 H 0 1 N N N -1.831 39.955 61.747 -16.972 -2.301 -1.027 H63 C9V 170 C9V H64 H64 H 0 1 N N N -2.571 41.547 62.127 -17.734 -2.187 -2.631 H64 C9V 171 C9V H65 H65 H 0 1 N N N -4.621 40.999 61.062 -19.246 -4.064 -2.048 H65 C9V 172 C9V H66 H66 H 0 1 N N N -4.329 39.231 61.189 -18.484 -4.178 -0.443 H66 C9V 173 C9V H67 H67 H 0 1 N N N -2.708 39.287 59.391 -19.180 -1.850 0.054 H67 C9V 174 C9V H68 H68 H 0 1 N N N -2.686 41.083 59.383 -19.942 -1.736 -1.551 H68 C9V 175 C9V H69 H69 H 0 1 N N N -4.867 41.215 58.450 -21.453 -3.613 -0.967 H69 C9V 176 C9V H70 H70 H 0 1 N N N -5.219 39.493 58.818 -20.691 -3.728 0.637 H70 C9V 177 C9V H71 H71 H 0 1 N N N -4.794 39.822 56.389 -21.387 -1.400 1.134 H71 C9V 178 C9V H72 H72 H 0 1 N N N -3.175 40.507 56.760 -22.149 -1.285 -0.471 H72 C9V 179 C9V H73 H73 H 0 1 N N N -3.527 38.785 57.128 -22.794 -2.417 0.742 H73 C9V 180 C9V H74 H74 H 0 1 N N N 8.133 40.962 65.466 2.201 -6.083 1.569 H74 C9V 181 C9V H75 H75 H 0 1 N N N 7.518 39.496 64.628 0.651 -5.227 1.384 H75 C9V 182 C9V H76 H76 H 0 1 N N N 6.501 41.301 63.498 -0.182 -7.134 -0.023 H76 C9V 183 C9V H77 H77 H 0 1 N N N 7.866 40.813 62.438 1.339 -7.999 0.309 H77 C9V 184 C9V H78 H78 H 0 1 N N N 9.090 42.803 62.858 0.849 -7.819 2.766 H78 C9V 185 C9V H79 H79 H 0 1 N N N 8.379 43.024 64.493 -0.720 -7.081 2.365 H79 C9V 186 C9V H81 H81 H 0 1 N N N 14.261 37.651 69.037 6.328 -6.559 -0.523 H81 C9V 187 C9V H82 H82 H 0 1 N N N 12.620 39.812 66.400 3.950 -5.501 -2.308 H82 C9V 188 C9V H83 H83 H 0 1 N N N 12.043 39.416 68.054 4.288 -4.082 -3.329 H83 C9V 189 C9V H84 H84 H 0 1 N N N 10.205 42.477 69.307 2.524 0.044 1.041 H84 C9V 190 C9V H85 H85 H 0 1 N N N 2.740 41.863 60.791 -9.733 7.312 1.672 H85 C9V 191 C9V H86 H86 H 0 1 N N N 2.293 40.941 62.267 -9.246 7.137 3.375 H86 C9V 192 C9V H87 H87 H 0 1 N N N 1.150 39.362 61.088 -8.819 9.576 3.503 H87 C9V 193 C9V H88 H88 H 0 1 N N N 2.382 39.305 59.781 -9.305 9.751 1.800 H88 C9V 194 C9V H89 H89 H 0 1 N N N 0.878 41.856 59.722 -11.072 8.701 4.057 H89 C9V 195 C9V H90 H90 H 0 1 N N N -0.225 40.443 59.610 -11.558 8.875 2.354 H90 C9V 196 C9V H91 H91 H 0 1 N N N -0.568 36.280 71.532 -8.820 -1.498 -4.166 H91 C9V 197 C9V H92 H92 H 0 1 N N N 0.679 36.412 70.245 -7.966 -3.052 -4.007 H92 C9V 198 C9V H93 H93 H 0 1 N N N -0.535 39.034 70.951 -9.553 -3.743 -2.232 H93 C9V 199 C9V H94 H94 H 0 1 N N N -1.741 37.844 70.355 -10.407 -2.189 -2.391 H94 C9V 200 C9V H95 H95 H 0 1 N N N 0.444 37.553 68.589 -10.067 -4.267 -4.600 H95 C9V 201 C9V H96 H96 H 0 1 N N N 0.341 39.324 68.872 -10.921 -2.714 -4.759 H96 C9V 202 C9V H97 H97 H 0 1 N N N 9.488 43.156 59.883 2.559 -8.919 3.548 H97 C9V 203 C9V H98 H98 H 0 1 N N N 8.990 41.930 61.098 3.638 -9.533 2.273 H98 C9V 204 C9V H99 H99 H 0 1 N N N 8.727 41.619 59.349 2.356 -8.366 1.869 H99 C9V 205 C9V H100 H100 H 0 0 N N N 6.649 42.857 58.127 2.942 -12.137 2.426 H100 C9V 206 C9V H101 H101 H 0 0 N N N 3.370 43.354 58.795 0.430 -14.295 2.837 H101 C9V 207 C9V H102 H102 H 0 0 N N N 3.611 45.090 59.184 -0.115 -14.135 1.151 H102 C9V 208 C9V H103 H103 H 0 0 N N N 4.394 44.378 57.733 1.619 -14.309 1.512 H103 C9V 209 C9V H104 H104 H 0 0 N N N 2.535 46.491 65.295 -5.238 -11.684 1.753 H104 C9V 210 C9V H105 H105 H 0 0 N N N 2.859 46.940 63.586 -5.558 -11.001 0.140 H105 C9V 211 C9V H106 H106 H 0 0 N N N 2.127 45.345 63.972 -4.275 -12.217 0.354 H106 C9V 212 C9V H107 H107 H 0 0 N N N 4.749 45.786 66.552 -5.032 -8.464 0.909 H107 C9V 213 C9V H108 H108 H 0 0 N N N 16.037 37.368 60.435 10.413 0.400 -1.059 H108 C9V 214 C9V H109 H109 H 0 0 N N N 14.356 37.376 61.069 9.671 0.657 0.538 H109 C9V 215 C9V H110 H110 H 0 0 N N N 14.027 35.972 59.254 11.972 0.764 1.539 H110 C9V 216 C9V H111 H111 H 0 0 N N N 14.542 34.735 60.451 12.654 0.640 -0.100 H111 C9V 217 C9V H112 H112 H 0 0 N N N 16.609 34.399 59.425 11.362 2.697 -0.743 H112 C9V 218 C9V H113 H113 H 0 0 N N N 16.704 36.085 58.813 10.823 2.844 0.947 H113 C9V 219 C9V H114 H114 H 0 0 N N N 15.154 35.623 57.018 13.185 2.997 1.688 H114 C9V 220 C9V H115 H115 H 0 0 N N N 14.689 34.043 57.734 13.724 2.849 -0.002 H115 C9V 221 C9V H116 H116 H 0 0 N N N 16.750 33.004 57.069 12.488 4.921 -0.578 H116 C9V 222 C9V H117 H117 H 0 0 N N N 17.551 34.583 56.769 11.949 5.068 1.112 H117 C9V 223 C9V H118 H118 H 0 0 N N N 16.699 33.121 54.705 14.311 5.221 1.853 H118 C9V 224 C9V H119 H119 H 0 0 N N N 16.458 34.901 54.694 14.850 5.074 0.163 H119 C9V 225 C9V H120 H120 H 0 0 N N N 14.233 33.498 56.008 13.615 7.145 -0.413 H120 C9V 226 C9V H121 H121 H 0 0 N N N 14.483 32.936 54.321 13.075 7.293 1.277 H121 C9V 227 C9V H122 H122 H 0 0 N N N 14.615 35.962 54.376 15.615 7.487 1.941 H122 C9V 228 C9V H123 H123 H 0 0 N N N 12.060 34.226 54.289 15.265 8.600 -0.861 H123 C9V 229 C9V H124 H124 H 0 0 N N N 12.753 37.263 53.825 16.832 10.226 0.492 H124 C9V 230 C9V H80 H80 H 0 1 N N N 11.866 36.344 52.563 17.359 8.805 1.425 H80 C9V 231 C9V H125 H125 H 0 0 N N N 10.001 35.948 54.104 18.237 7.767 -0.649 H125 C9V 232 C9V H126 H126 H 0 0 N N N 10.900 36.742 55.441 17.710 9.188 -1.582 H126 C9V 233 C9V H128 H128 H 0 0 N N N 10.974 38.758 53.580 19.192 10.634 -0.219 H128 C9V 234 C9V H127 H127 H 0 0 N N N 9.437 37.963 53.098 19.719 9.214 0.715 H127 C9V 235 C9V H129 H129 H 0 0 N N N 10.149 39.205 55.821 20.597 8.176 -1.359 H129 C9V 236 C9V H136 H136 H 0 0 N N N 8.852 39.708 54.684 20.070 9.597 -2.293 H136 C9V 237 C9V H137 H137 H 0 0 N N N 7.920 37.263 55.086 21.553 11.043 -0.929 H137 C9V 238 C9V H130 H130 H 0 0 N N N 8.952 37.306 56.555 22.080 9.622 0.005 H130 C9V 239 C9V H131 H131 H 0 0 N N N 7.408 39.815 56.343 22.958 8.585 -2.069 H131 C9V 240 C9V H138 H138 H 0 0 N N N 6.297 38.407 56.250 22.431 10.006 -3.003 H138 C9V 241 C9V H135 H135 H 0 0 N N N 6.975 37.583 58.396 23.913 11.452 -1.639 H135 C9V 242 C9V H132 H132 H 0 0 N N N 8.450 38.608 58.418 24.440 10.031 -0.705 H132 C9V 243 C9V H134 H134 H 0 0 N N N 6.713 39.500 59.968 24.791 10.415 -3.713 H134 C9V 244 C9V H133 H133 H 0 0 N N N 7.029 40.650 58.625 26.073 10.580 -2.489 H133 C9V 245 C9V H139 H139 H 0 0 N N N 5.554 39.625 58.602 25.318 8.994 -2.780 H139 C9V 246 # 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 C9V CAH CAG SING N N 1 C9V CAH CAI SING N N 2 C9V C56 C57 SING N N 3 C9V C56 C55 SING N N 4 C9V C59 C58 SING N N 5 C9V C59 C60 SING N N 6 C9V CAJ CAI SING N N 7 C9V CAJ CAK SING N N 8 C9V CAG CAF DOUB N E 9 C9V C57 C58 SING N N 10 C9V C54 C55 SING N N 11 C9V C54 C53 SING N N 12 C9V CAF CAE SING N N 13 C9V CAE CAD SING N N 14 C9V CAK CAL SING N N 15 C9V CAD CAC SING N N 16 C9V C53 C52 SING N N 17 C9V CAL CAM SING N N 18 C9V CAM CAN SING N N 19 C9V CAC CAB SING N N 20 C9V C52 C51 DOUB N E 21 C9V C80 C79 SING N N 22 C9V CAB CAA SING N N 23 C9V C51 C50 SING N N 24 C9V CAN CAO SING N N 25 C9V C79 C78 SING N N 26 C9V C93 C92 SING N N 27 C9V CAA CA9 SING N N 28 C9V C91 C92 DOUB Y N 29 C9V C91 C89 SING Y N 30 C9V C50 C49 SING N N 31 C9V C78 C77 SING N N 32 C9V C92 N94 SING Y N 33 C9V CA9 CA8 SING N N 34 C9V C90 C89 SING N N 35 C9V C89 C88 DOUB Y N 36 C9V C49 C48 SING N N 37 C9V CA8 CA6 SING N N 38 C9V N94 C88 SING Y N 39 C9V N94 B95 SING N N 40 C9V C77 C76 SING N N 41 C9V C48 C47 SING N N 42 C9V C18 C19 SING N N 43 C9V F96 B95 SING N N 44 C9V C47 C46 SING N N 45 C9V C88 C87 SING N N 46 C9V O20 C19 DOUB N N 47 C9V F97 B95 SING N N 48 C9V B95 N98 SING N N 49 C9V C76 C75 SING N N 50 C9V C19 O21 SING N N 51 C9V CA6 OA7 DOUB N N 52 C9V CA6 OA5 SING N N 53 C9V C46 C45 SING N N 54 C9V C87 C86 SING N N 55 C9V C87 CA4 DOUB N N 56 C9V O83 C82 DOUB N N 57 C9V O21 C22 SING N N 58 C9V N98 CA4 SING N N 59 C9V N98 C99 DOUB N N 60 C9V C85 C86 SING N N 61 C9V C85 C84 SING N N 62 C9V C75 C74 SING N N 63 C9V OA5 C23 SING N N 64 C9V C22 C23 SING N N 65 C9V CA4 CA2 SING N N 66 C9V C45 C44 SING N N 67 C9V C23 C24 SING N N 68 C9V C82 C84 SING N N 69 C9V C82 O81 SING N N 70 C9V CA0 C99 SING N N 71 C9V C74 C73 SING N N 72 C9V C99 CA1 SING N N 73 C9V C44 C42 SING N N 74 C9V O81 C31 SING N N 75 C9V CA2 CA1 DOUB N N 76 C9V CA2 CA3 SING N N 77 C9V C73 C72 SING N N 78 C9V C24 O25 SING N N 79 C9V O25 P26 SING N N 80 C9V O43 C42 DOUB N N 81 C9V C42 O41 SING N N 82 C9V C31 C30 SING N N 83 C9V C31 C32 SING N N 84 C9V C72 C71 DOUB N E 85 C9V O29 C30 SING N N 86 C9V O29 P26 SING N N 87 C9V P26 O28 DOUB N N 88 C9V P26 O27 SING N N 89 C9V C32 O33 SING N N 90 C9V O41 C40 SING N N 91 C9V O36 P34 DOUB N N 92 C9V C71 C70 SING N N 93 C9V C40 C39 SING N N 94 C9V O33 P34 SING N N 95 C9V C70 C69 SING N N 96 C9V O61 C39 SING N N 97 C9V O61 C62 SING N N 98 C9V P34 O35 SING N N 99 C9V P34 O37 SING N N 100 C9V C39 C38 SING N N 101 C9V O63 C62 DOUB N N 102 C9V C62 C64 SING N N 103 C9V O37 C38 SING N N 104 C9V C69 C68 SING N N 105 C9V C64 C65 SING N N 106 C9V C68 C67 SING N N 107 C9V C66 C65 SING N N 108 C9V C66 C67 SING N N 109 C9V CA3 H1 SING N N 110 C9V CA3 H2 SING N N 111 C9V CA3 H3 SING N N 112 C9V C18 H4 SING N N 113 C9V C18 H5 SING N N 114 C9V C18 H6 SING N N 115 C9V C22 H7 SING N N 116 C9V C22 H8 SING N N 117 C9V C23 H9 SING N N 118 C9V C24 H10 SING N N 119 C9V C24 H11 SING N N 120 C9V C31 H12 SING N N 121 C9V C32 H13 SING N N 122 C9V C32 H14 SING N N 123 C9V C38 H15 SING N N 124 C9V C38 H16 SING N N 125 C9V C39 H17 SING N N 126 C9V C40 H18 SING N N 127 C9V C40 H19 SING N N 128 C9V C44 H20 SING N N 129 C9V C44 H21 SING N N 130 C9V C45 H22 SING N N 131 C9V C45 H23 SING N N 132 C9V C46 H24 SING N N 133 C9V C46 H25 SING N N 134 C9V C47 H26 SING N N 135 C9V C47 H27 SING N N 136 C9V C51 H28 SING N N 137 C9V C52 H29 SING N N 138 C9V C53 H30 SING N N 139 C9V C53 H31 SING N N 140 C9V C54 H32 SING N N 141 C9V C54 H33 SING N N 142 C9V C55 H34 SING N N 143 C9V C55 H35 SING N N 144 C9V C56 H36 SING N N 145 C9V C56 H37 SING N N 146 C9V C57 H38 SING N N 147 C9V C57 H39 SING N N 148 C9V C58 H40 SING N N 149 C9V C58 H41 SING N N 150 C9V C59 H42 SING N N 151 C9V C59 H43 SING N N 152 C9V C60 H44 SING N N 153 C9V C60 H45 SING N N 154 C9V C60 H46 SING N N 155 C9V C64 H47 SING N N 156 C9V C64 H48 SING N N 157 C9V C65 H49 SING N N 158 C9V C65 H50 SING N N 159 C9V C66 H51 SING N N 160 C9V C66 H52 SING N N 161 C9V C67 H53 SING N N 162 C9V C67 H54 SING N N 163 C9V C71 H55 SING N N 164 C9V C72 H56 SING N N 165 C9V C73 H57 SING N N 166 C9V C73 H58 SING N N 167 C9V C74 H59 SING N N 168 C9V C74 H60 SING N N 169 C9V C75 H61 SING N N 170 C9V C75 H62 SING N N 171 C9V C76 H63 SING N N 172 C9V C76 H64 SING N N 173 C9V C77 H65 SING N N 174 C9V C77 H66 SING N N 175 C9V C78 H67 SING N N 176 C9V C78 H68 SING N N 177 C9V C79 H69 SING N N 178 C9V C79 H70 SING N N 179 C9V C80 H71 SING N N 180 C9V C80 H72 SING N N 181 C9V C80 H73 SING N N 182 C9V C84 H74 SING N N 183 C9V C84 H75 SING N N 184 C9V C85 H76 SING N N 185 C9V C85 H77 SING N N 186 C9V C86 H78 SING N N 187 C9V C86 H79 SING N N 188 C9V O27 H81 SING N N 189 C9V C30 H82 SING N N 190 C9V C30 H83 SING N N 191 C9V O35 H84 SING N N 192 C9V C48 H85 SING N N 193 C9V C48 H86 SING N N 194 C9V C49 H87 SING N N 195 C9V C49 H88 SING N N 196 C9V C50 H89 SING N N 197 C9V C50 H90 SING N N 198 C9V C68 H91 SING N N 199 C9V C68 H92 SING N N 200 C9V C69 H93 SING N N 201 C9V C69 H94 SING N N 202 C9V C70 H95 SING N N 203 C9V C70 H96 SING N N 204 C9V C90 H97 SING N N 205 C9V C90 H98 SING N N 206 C9V C90 H99 SING N N 207 C9V C91 H100 SING N N 208 C9V C93 H101 SING N N 209 C9V C93 H102 SING N N 210 C9V C93 H103 SING N N 211 C9V CA0 H104 SING N N 212 C9V CA0 H105 SING N N 213 C9V CA0 H106 SING N N 214 C9V CA1 H107 SING N N 215 C9V CA8 H108 SING N N 216 C9V CA8 H109 SING N N 217 C9V CA9 H110 SING N N 218 C9V CA9 H111 SING N N 219 C9V CAA H112 SING N N 220 C9V CAA H113 SING N N 221 C9V CAB H114 SING N N 222 C9V CAB H115 SING N N 223 C9V CAC H116 SING N N 224 C9V CAC H117 SING N N 225 C9V CAD H118 SING N N 226 C9V CAD H119 SING N N 227 C9V CAE H120 SING N N 228 C9V CAE H121 SING N N 229 C9V CAF H122 SING N N 230 C9V CAG H123 SING N N 231 C9V CAH H124 SING N N 232 C9V CAH H80 SING N N 233 C9V CAI H125 SING N N 234 C9V CAI H126 SING N N 235 C9V CAJ H128 SING N N 236 C9V CAJ H127 SING N N 237 C9V CAK H129 SING N N 238 C9V CAK H136 SING N N 239 C9V CAL H137 SING N N 240 C9V CAL H130 SING N N 241 C9V CAM H131 SING N N 242 C9V CAM H138 SING N N 243 C9V CAN H135 SING N N 244 C9V CAN H132 SING N N 245 C9V CAO H134 SING N N 246 C9V CAO H133 SING N N 247 C9V CAO H139 SING N N 248 # 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 C9V SMILES ACDLabs 12.01 "C1(=CC(=[N+]3C1=C(CCCC(OC(COP(OCC(OC(=O)CCCCCCC[C@H]=[C@H]CCCCCCCC)COC(C)=O)(=O)O)COP(O)(OCC(COC(CCCCCCC[C@H]=[C@H]CCCCCCCC)=O)OC(CCCCCCC[C@H]=[C@H]CCCCCCCC)=O)=O)=O)c2c(C)cc(n2[B-]3(F)F)C)C)C" C9V InChI InChI 1.03 ;InChI=1S/C82H139BF2N2O18P2/c1-9-12-15-18-21-24-27-30-33-36-39-42-45-48-51-56-77(89)98-63-74(104-79(91)58-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-3)65-100-107(95,96)102-67-75(105-80(92)59-54-55-76-81-68(4)60-70(6)86(81)83(84,85)87-71(7)61-69(5)82(76)87)66-101-106(93,94)99-64-73(62-97-72(8)88)103-78(90)57-52-49-46-43-40-37-34-31-28-25-22-19-16-13-10-2/h30-35,60-61,73-75H,9-29,36-59,62-67H2,1-8H3,(H,93,94)(H,95,96)/b33-30+,34-31+,35-32+/t73-,74+,75+/m0/s1 ; C9V InChIKey InChI 1.03 GDYLGRNGCDWDQL-UUEIIFSHSA-N C9V SMILES_CANONICAL CACTVS 3.385 "CCCCCCCC\C=C\CCCCCCCC(=O)OC[C@H](CO[P](O)(=O)OC[C@@H](CO[P](O)(=O)OC[C@H](COC(C)=O)OC(=O)CCCCCCC/C=C/CCCCCCCC)OC(=O)CCCC1=C2C(=CC(=[N+]2[B-](F)(F)n3c(C)cc(C)c13)C)C)OC(=O)CCCCCCC/C=C/CCCCCCCC" C9V SMILES CACTVS 3.385 "CCCCCCCCC=CCCCCCCCC(=O)OC[CH](CO[P](O)(=O)OC[CH](CO[P](O)(=O)OC[CH](COC(C)=O)OC(=O)CCCCCCCC=CCCCCCCCC)OC(=O)CCCC1=C2C(=CC(=[N+]2[B-](F)(F)n3c(C)cc(C)c13)C)C)OC(=O)CCCCCCCC=CCCCCCCCC" C9V SMILES_CANONICAL "OpenEye OEToolkits" 2.0.6 "[B-]1(n2c(cc(c2C(=C3[N+]1=C(C=C3C)C)CCCC(=O)O[C@H](COP(=O)(O)OC[C@H](COC(=O)C)OC(=O)CCCCCCC/C=C/CCCCCCCC)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCC/C=C/CCCCCCCC)OC(=O)CCCCCCC/C=C/CCCCCCCC)C)C)(F)F" C9V SMILES "OpenEye OEToolkits" 2.0.6 "[B-]1(n2c(cc(c2C(=C3[N+]1=C(C=C3C)C)CCCC(=O)OC(COP(=O)(O)OCC(COC(=O)C)OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCC=CCCCCCCCC)C)C)(F)F" # 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 C9V "SYSTEMATIC NAME" ACDLabs 12.01 ;[(2R,5R,11R,14S,24E)-14-[(acetyloxy)methyl]-8-{[5-(3,5-dimethyl-1H-pyrrol-2-yl-kappaN)-5-(3,5-dimethyl-2H-pyrrol-2-ylidene-kappaN)pentanoyl]oxy}-5,11-dihydroxy-2-{[(9E)-octadec-9-enoyl]oxy}-5,11,16-trioxo-4,6,10,12,15-pentaoxa-5lambda~5~,11lambda~5~-diphosphatritriacont-24-en-1-yl (9E)-octadec-9-enoatato](difluoro)boron ; C9V "SYSTEMATIC NAME" "OpenEye OEToolkits" 2.0.6 ;[(2~{R})-3-[[(2~{R})-3-[[(2~{S})-3-acetyloxy-2-[(~{E})-octadec-9-enoyl]oxy-propoxy]-oxidanyl-phosphoryl]oxy-2-[4-[2,2-bis(fluoranyl)-4,6,10,12-tetramethyl-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.0^{3,7}]dodeca-1(12),4,6,8,10-pentaen-8-yl]butanoyloxy]propoxy]-oxidanyl-phosphoryl]oxy-2-[(~{E})-octadec-9-enoyl]oxy-propyl] (~{E})-octadec-9-enoate ; # loop_ _pdbx_chem_comp_audit.comp_id _pdbx_chem_comp_audit.action_type _pdbx_chem_comp_audit.date _pdbx_chem_comp_audit.processing_site C9V "Create component" 2017-09-20 RCSB C9V "Initial release" 2018-03-07 RCSB #