data_232 # _chem_comp.id 232 _chem_comp.name "1,3-DI[[[10-METHOXY-7H-PYRIDO[4,3-C]CARBAZOL-2-IUMYL]-ETHYL]-PIPERIDIN-4-YL]-PROPANE" _chem_comp.type NON-POLYMER _chem_comp.pdbx_type HETAD _chem_comp.formula "C49 H56 N6 O2" _chem_comp.mon_nstd_parent_comp_id ? _chem_comp.pdbx_synonyms "BIS INTERCALATOR D232" _chem_comp.pdbx_formal_charge 2 _chem_comp.pdbx_initial_date 1999-10-08 _chem_comp.pdbx_modified_date 2020-06-17 _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 761.008 _chem_comp.one_letter_code ? _chem_comp.three_letter_code 232 _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 1C9Z _chem_comp.pdbx_subcomponent_list ? _chem_comp.pdbx_processing_site PDBJ # # 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 232 C1 C1 C 0 1 Y N N 3.302 17.127 61.944 7.620 -1.185 0.061 C1 232 1 232 N2 N2 N 1 1 Y N N 3.432 18.453 61.680 6.439 -1.480 0.555 N2 232 2 232 C3 C3 C 0 1 Y N N 4.522 18.977 61.079 6.192 -2.617 1.189 C3 232 3 232 C4 C4 C 0 1 Y N N 5.544 18.179 60.709 7.156 -3.563 1.371 C4 232 4 232 C5 C5 C 0 1 Y N N 6.534 15.999 60.567 9.496 -4.239 1.014 C5 232 5 232 C6 C6 C 0 1 Y N N 6.475 14.668 60.808 10.730 -3.972 0.518 C6 232 6 232 N7 N7 N 0 1 Y N N 5.088 12.805 61.826 12.173 -2.295 -0.736 N7 232 7 232 C8 C8 C 0 1 Y N N 3.136 11.692 62.947 12.780 -0.160 -1.969 C8 232 8 232 C9 C9 C 0 1 Y N N 1.936 11.868 63.538 12.285 1.045 -2.417 C9 232 9 232 C11 C11 C 0 1 Y N N 2.118 14.306 63.060 10.119 0.526 -1.515 C11 232 10 232 C12 C12 C 0 1 Y N N 5.465 16.810 60.978 8.446 -3.318 0.869 C12 232 11 232 C13 C13 C 0 1 Y N N 5.368 14.111 61.463 11.013 -2.776 -0.156 C13 232 12 232 C14 C14 C 0 1 Y N N 3.841 12.771 62.414 11.952 -1.046 -1.287 C14 232 13 232 C15 C15 C 0 1 Y N N 3.362 14.072 62.465 10.609 -0.699 -1.062 C15 232 14 232 C16 C16 C 0 1 Y N N 4.293 14.900 61.861 10.008 -1.822 -0.330 C16 232 15 232 C17 C17 C 0 1 Y N N 4.339 16.258 61.595 8.678 -2.091 0.195 C17 232 16 232 C19 C19 C 0 1 N N N 2.316 19.430 62.028 5.350 -0.513 0.398 C19 232 17 232 C10 C10 C 0 1 Y N N 1.388 13.186 63.621 10.955 1.389 -2.195 C10 232 18 232 O10 O10 O 0 1 N N N 0.143 13.247 64.264 10.480 2.582 -2.644 O10 232 19 232 C18 C18 C 0 1 N N N -0.383 14.523 64.344 11.568 3.243 -3.292 C18 232 20 232 C20 C20 C 0 1 N N N 1.066 19.194 61.146 5.340 0.442 1.594 C20 232 21 232 N21 N21 N 0 1 N N N 1.204 19.462 59.676 4.335 1.491 1.375 N21 232 22 232 C22 C22 C 0 1 N N N -0.013 18.922 59.017 4.311 2.312 2.591 C22 232 23 232 C23 C23 C 0 1 N N N 0.100 18.946 57.490 3.277 3.429 2.440 C23 232 24 232 C24 C24 C 0 1 N N N 0.307 20.377 56.996 1.889 2.808 2.251 C24 232 25 232 C25 C25 C 0 1 N N N 1.429 21.135 57.775 1.931 1.851 1.056 C25 232 26 232 C26 C26 C 0 1 N N N 1.354 20.911 59.322 3.036 0.816 1.278 C26 232 27 232 C27 C27 C 0 1 N N N 0.790 20.194 55.573 0.865 3.914 1.987 C27 232 28 232 C28 C28 C 0 1 N N N 0.000 21.029 54.558 -0.537 3.305 1.922 C28 232 29 232 "C1'" "C1'" C 0 1 Y N N -3.302 17.127 47.172 -8.486 0.462 -1.147 "C1'" 232 30 232 "N2'" "N2'" N 1 1 Y N N -3.432 18.453 47.436 -8.294 1.706 -1.523 "N2'" 232 31 232 "C3'" "C3'" C 0 1 Y N N -4.522 18.977 48.037 -9.270 2.469 -1.994 "C3'" 232 32 232 "C4'" "C4'" C 0 1 Y N N -5.544 18.179 48.407 -10.547 2.011 -2.115 "C4'" 232 33 232 "C5'" "C5'" C 0 1 Y N N -6.534 15.999 48.549 -12.118 0.140 -1.820 "C5'" 232 34 232 "C6'" "C6'" C 0 1 Y N N -6.475 14.668 48.308 -12.359 -1.139 -1.438 "C6'" 232 35 232 "N7'" "N7'" N 0 1 Y N N -5.088 12.805 47.290 -11.352 -3.274 -0.493 "N7'" 232 36 232 "C8'" "C8'" C 0 1 Y N N -3.136 11.692 46.169 -9.581 -4.843 0.426 "C8'" 232 37 232 "C9'" "C9'" C 0 1 Y N N -1.936 11.868 45.578 -8.246 -4.945 0.751 "C9'" 232 38 232 "CB'" "C11'" C 0 1 Y N N -2.118 14.306 46.056 -7.872 -2.674 0.060 "CB'" 232 39 232 "CC'" "C12'" C 0 1 Y N N -5.465 16.810 48.138 -10.830 0.690 -1.727 "CC'" 232 40 232 "CD'" "C13'" C 0 1 Y N N -5.368 14.111 47.653 -11.343 -1.964 -0.936 "CD'" 232 41 232 "CE'" "C14'" C 0 1 Y N N -3.841 12.771 46.702 -10.085 -3.653 -0.089 "CE'" 232 42 232 "CF'" "C15'" C 0 1 Y N N -3.362 14.072 46.651 -9.222 -2.560 -0.272 "CF'" 232 43 232 "CG'" "C16'" C 0 1 Y N N -4.293 14.900 47.255 -10.041 -1.472 -0.821 "CG'" 232 44 232 "CH'" "C17'" C 0 1 Y N N -4.339 16.258 47.521 -9.764 -0.102 -1.227 "CH'" 232 45 232 "CJ'" "C19'" C 0 1 N N N -2.316 19.430 47.088 -6.946 2.271 -1.422 "CJ'" 232 46 232 "CA'" "C10'" C 0 1 Y N N -1.388 13.186 45.495 -7.389 -3.864 0.570 "CA'" 232 47 232 "OA'" "O10'" O 0 1 N N N -0.143 13.247 44.852 -6.074 -3.979 0.895 "OA'" 232 48 232 "CI'" "C18'" C 0 1 N N N 0.383 14.523 44.772 -5.885 -5.307 1.388 "CI'" 232 49 232 "CK'" "C20'" C 0 1 N N N -1.066 19.194 47.970 -6.767 2.922 -0.049 "CK'" 232 50 232 "NL'" "N21'" N 0 1 N N N -1.204 19.462 49.440 -5.416 3.489 0.052 "NL'" 232 51 232 "CM'" "C22'" C 0 1 N N N 0.013 18.922 50.099 -5.388 4.299 1.274 "CM'" 232 52 232 "CN'" "C23'" C 0 1 N N N -0.100 18.946 51.626 -4.002 4.920 1.452 "CN'" 232 53 232 "CO'" "C24'" C 0 1 N N N -0.307 20.377 52.120 -2.963 3.802 1.593 "CO'" 232 54 232 "CP'" "C25'" C 0 1 N N N -1.429 21.135 51.341 -3.065 2.875 0.378 "CP'" 232 55 232 "CQ'" "C26'" C 0 1 N N N -1.354 20.911 49.794 -4.500 2.361 0.255 "CQ'" 232 56 232 "CR'" "C27'" C 0 1 N N N -0.790 20.194 53.543 -1.561 4.411 1.657 "CR'" 232 57 232 H1 H1 H 0 1 N N N 2.379 16.765 62.428 7.774 -0.245 -0.448 H1 232 58 232 H3 H3 H 0 1 N N N 4.577 20.062 60.889 5.199 -2.800 1.572 H3 232 59 232 H4 H4 H 0 1 N N N 6.414 18.630 60.203 6.934 -4.484 1.890 H4 232 60 232 H5 H5 H 0 1 N N N 7.420 16.407 60.054 9.318 -5.173 1.527 H5 232 61 232 H6 H6 H 0 1 N N N 7.320 14.043 60.474 11.516 -4.701 0.646 H6 232 62 232 H7 H7 H 0 1 N N N 5.699 12.000 61.683 13.020 -2.766 -0.753 H7 232 63 232 H8 H8 H 0 1 N N N 3.540 10.666 62.899 13.814 -0.418 -2.147 H8 232 64 232 H9 H9 H 0 1 N N N 1.425 10.974 63.935 12.934 1.727 -2.946 H9 232 65 232 H11 H11 H 0 1 N N N 1.726 15.336 63.085 9.088 0.796 -1.337 H11 232 66 232 H191 1H19 H 0 0 N N N 2.063 19.393 63.113 5.499 0.057 -0.519 H191 232 67 232 H192 2H19 H 0 0 N N N 2.664 20.487 61.968 4.398 -1.041 0.347 H192 232 68 232 H181 1H18 H 0 0 N N N -1.372 14.571 64.855 11.233 4.209 -3.670 H181 232 69 232 H182 2H18 H 0 0 N N N 0.343 15.217 64.828 12.378 3.394 -2.578 H182 232 70 232 H183 3H18 H 0 0 N N N -0.440 14.987 63.332 11.923 2.632 -4.121 H183 232 71 232 H201 1H20 H 0 0 N N N 0.694 18.154 61.300 5.095 -0.113 2.500 H201 232 72 232 H202 2H20 H 0 0 N N N 0.209 19.782 61.551 6.324 0.898 1.703 H202 232 73 232 H221 1H22 H 0 0 N N N -0.253 17.898 59.388 4.049 1.687 3.445 H221 232 74 232 H222 2H22 H 0 0 N N N -0.929 19.454 59.362 5.296 2.749 2.752 H222 232 75 232 H231 1H23 H 0 0 N N N 0.897 18.259 57.121 3.279 4.050 3.336 H231 232 76 232 H232 2H23 H 0 0 N N N -0.775 18.459 57.000 3.524 4.039 1.572 H232 232 77 232 H24 H24 H 0 1 N N N -0.628 20.970 57.118 1.609 2.259 3.150 H24 232 78 232 H251 1H25 H 0 0 N N N 2.437 20.867 57.381 0.971 1.344 0.961 H251 232 79 232 H252 2H25 H 0 0 N N N 1.420 22.222 57.528 2.138 2.414 0.146 H252 232 80 232 H261 1H26 H 0 0 N N N 0.543 21.524 59.780 3.052 0.118 0.442 H261 232 81 232 H262 2H26 H 0 0 N N N 2.232 21.364 59.838 2.841 0.271 2.202 H262 232 82 232 H271 1H27 H 0 0 N N N 1.882 20.402 55.494 0.906 4.647 2.792 H271 232 83 232 H272 2H27 H 0 0 N N N 0.788 19.116 55.288 1.094 4.401 1.039 H272 232 84 232 H281 1H28 H 0 0 N N N -0.672 21.747 55.081 -0.578 2.571 1.117 H281 232 85 232 H282 2H28 H 0 0 N N N 0.672 21.747 54.034 -0.766 2.818 2.870 H282 232 86 232 "H1'" "H1'" H 0 1 N N N -2.379 16.765 46.687 -7.659 -0.124 -0.773 "H1'" 232 87 232 "H3'" "H3'" H 0 1 N N N -4.577 20.062 48.226 -9.046 3.484 -2.291 "H3'" 232 88 232 "H4'" "H4'" H 0 1 N N N -6.414 18.630 48.912 -11.327 2.650 -2.501 "H4'" 232 89 232 "H5'" "H5'" H 0 1 N N N -7.420 16.407 49.061 -12.929 0.744 -2.201 "H5'" 232 90 232 "H6'" "H6'" H 0 1 N N N -7.320 14.043 48.642 -13.362 -1.532 -1.522 "H6'" 232 91 232 "H7'" "H7'" H 0 1 N N N -5.699 12.000 47.432 -12.136 -3.845 -0.469 "H7'" 232 92 232 "H8'" "H8'" H 0 1 N N N -3.540 10.666 46.216 -10.237 -5.689 0.571 "H8'" 232 93 232 "H9'" "H9'" H 0 1 N N N -1.425 10.974 45.180 -7.861 -5.872 1.151 "H9'" 232 94 232 "H11'" "H11'" H 0 0 N N N -1.726 15.336 46.030 -7.206 -1.835 -0.081 "H11'" 232 95 232 H193 3H19 H 0 0 N N N -2.063 19.393 46.002 -6.807 3.020 -2.201 H193 232 96 232 H194 4H19 H 0 0 N N N -2.664 20.487 47.147 -6.210 1.477 -1.546 H194 232 97 232 H184 4H18 H 0 0 N N N 1.372 14.571 44.260 -6.515 -5.463 2.263 H184 232 98 232 H185 5H18 H 0 0 N N N -0.343 15.217 44.288 -6.156 -6.024 0.613 H185 232 99 232 H186 6H18 H 0 0 N N N 0.440 14.987 45.783 -4.839 -5.447 1.663 H186 232 100 232 H203 3H20 H 0 0 N N N -0.694 18.154 47.816 -6.906 2.173 0.730 H203 232 101 232 H204 4H20 H 0 0 N N N -0.209 19.782 47.564 -7.504 3.716 0.075 H204 232 102 232 H223 3H22 H 0 0 N N N 0.253 17.898 49.727 -5.616 3.668 2.133 H223 232 103 232 H224 4H22 H 0 0 N N N 0.929 19.454 49.753 -6.133 5.091 1.200 H224 232 104 232 H233 3H23 H 0 0 N N N -0.897 18.259 51.994 -3.993 5.540 2.349 H233 232 105 232 H234 4H23 H 0 0 N N N 0.775 18.459 52.115 -3.762 5.532 0.583 H234 232 106 232 "H24'" "H24'" H 0 0 N N N 0.628 20.970 51.997 -3.158 3.236 2.503 "H24'" 232 107 232 H253 3H25 H 0 0 N N N -2.437 20.867 51.734 -2.797 3.425 -0.524 H253 232 108 232 H254 4H25 H 0 0 N N N -1.420 22.222 51.587 -2.386 2.032 0.506 H254 232 109 232 H263 3H26 H 0 0 N N N -0.543 21.524 49.336 -4.775 1.831 1.168 H263 232 110 232 H264 4H26 H 0 0 N N N -2.232 21.364 49.277 -4.570 1.679 -0.593 H264 232 111 232 H273 3H27 H 0 0 N N N -0.788 19.116 53.827 -1.520 5.144 2.462 H273 232 112 232 H274 4H27 H 0 0 N N N -1.882 20.402 53.621 -1.333 4.898 0.709 H274 232 113 # # 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 232 C1 N2 DOUB Y N 1 232 C1 C17 SING Y N 2 232 C1 H1 SING N N 3 232 N2 C3 SING Y N 4 232 N2 C19 SING N N 5 232 C3 C4 DOUB Y N 6 232 C3 H3 SING N N 7 232 C4 C12 SING Y N 8 232 C4 H4 SING N N 9 232 C5 C6 DOUB Y N 10 232 C5 C12 SING Y N 11 232 C5 H5 SING N N 12 232 C6 C13 SING Y N 13 232 C6 H6 SING N N 14 232 N7 C13 SING Y N 15 232 N7 C14 SING Y N 16 232 N7 H7 SING N N 17 232 C8 C9 DOUB Y N 18 232 C8 C14 SING Y N 19 232 C8 H8 SING N N 20 232 C9 C10 SING Y N 21 232 C9 H9 SING N N 22 232 C11 C15 SING Y N 23 232 C11 C10 DOUB Y N 24 232 C11 H11 SING N N 25 232 C12 C17 DOUB Y N 26 232 C13 C16 DOUB Y N 27 232 C14 C15 DOUB Y N 28 232 C15 C16 SING Y N 29 232 C16 C17 SING Y N 30 232 C19 C20 SING N N 31 232 C19 H191 SING N N 32 232 C19 H192 SING N N 33 232 C10 O10 SING N N 34 232 O10 C18 SING N N 35 232 C18 H181 SING N N 36 232 C18 H182 SING N N 37 232 C18 H183 SING N N 38 232 C20 N21 SING N N 39 232 C20 H201 SING N N 40 232 C20 H202 SING N N 41 232 N21 C22 SING N N 42 232 N21 C26 SING N N 43 232 C22 C23 SING N N 44 232 C22 H221 SING N N 45 232 C22 H222 SING N N 46 232 C23 C24 SING N N 47 232 C23 H231 SING N N 48 232 C23 H232 SING N N 49 232 C24 C25 SING N N 50 232 C24 C27 SING N N 51 232 C24 H24 SING N N 52 232 C25 C26 SING N N 53 232 C25 H251 SING N N 54 232 C25 H252 SING N N 55 232 C26 H261 SING N N 56 232 C26 H262 SING N N 57 232 C27 C28 SING N N 58 232 C27 H271 SING N N 59 232 C27 H272 SING N N 60 232 C28 "CR'" SING N N 61 232 C28 H281 SING N N 62 232 C28 H282 SING N N 63 232 "C1'" "N2'" DOUB Y N 64 232 "C1'" "CH'" SING Y N 65 232 "C1'" "H1'" SING N N 66 232 "N2'" "C3'" SING Y N 67 232 "N2'" "CJ'" SING N N 68 232 "C3'" "C4'" DOUB Y N 69 232 "C3'" "H3'" SING N N 70 232 "C4'" "CC'" SING Y N 71 232 "C4'" "H4'" SING N N 72 232 "C5'" "C6'" DOUB Y N 73 232 "C5'" "CC'" SING Y N 74 232 "C5'" "H5'" SING N N 75 232 "C6'" "CD'" SING Y N 76 232 "C6'" "H6'" SING N N 77 232 "N7'" "CD'" SING Y N 78 232 "N7'" "CE'" SING Y N 79 232 "N7'" "H7'" SING N N 80 232 "C8'" "C9'" DOUB Y N 81 232 "C8'" "CE'" SING Y N 82 232 "C8'" "H8'" SING N N 83 232 "C9'" "CA'" SING Y N 84 232 "C9'" "H9'" SING N N 85 232 "CB'" "CF'" SING Y N 86 232 "CB'" "CA'" DOUB Y N 87 232 "CB'" "H11'" SING N N 88 232 "CC'" "CH'" DOUB Y N 89 232 "CD'" "CG'" DOUB Y N 90 232 "CE'" "CF'" DOUB Y N 91 232 "CF'" "CG'" SING Y N 92 232 "CG'" "CH'" SING Y N 93 232 "CJ'" "CK'" SING N N 94 232 "CJ'" H193 SING N N 95 232 "CJ'" H194 SING N N 96 232 "CA'" "OA'" SING N N 97 232 "OA'" "CI'" SING N N 98 232 "CI'" H184 SING N N 99 232 "CI'" H185 SING N N 100 232 "CI'" H186 SING N N 101 232 "CK'" "NL'" SING N N 102 232 "CK'" H203 SING N N 103 232 "CK'" H204 SING N N 104 232 "NL'" "CM'" SING N N 105 232 "NL'" "CQ'" SING N N 106 232 "CM'" "CN'" SING N N 107 232 "CM'" H223 SING N N 108 232 "CM'" H224 SING N N 109 232 "CN'" "CO'" SING N N 110 232 "CN'" H233 SING N N 111 232 "CN'" H234 SING N N 112 232 "CO'" "CP'" SING N N 113 232 "CO'" "CR'" SING N N 114 232 "CO'" "H24'" SING N N 115 232 "CP'" "CQ'" SING N N 116 232 "CP'" H253 SING N N 117 232 "CP'" H254 SING N N 118 232 "CQ'" H263 SING N N 119 232 "CQ'" H264 SING N N 120 232 "CR'" H273 SING N N 121 232 "CR'" H274 SING N N 122 # # 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 232 SMILES ACDLabs 10.04 "O(c3cc4c2c1c[n+](ccc1ccc2nc4cc3)CCN5CCC(CC5)CCCC%10CCN(CC[n+]9cc8c7c6cc(OC)ccc6nc7ccc8cc9)CC%10)C" 232 SMILES_CANONICAL CACTVS 3.341 "COc1ccc2[nH]c3ccc4cc[n+](CCN5CCC(CCCC6CCN(CC6)CC[n+]7ccc8ccc9[nH]c%10ccc(OC)cc%10c9c8c7)CC5)cc4c3c2c1" 232 SMILES CACTVS 3.341 "COc1ccc2[nH]c3ccc4cc[n+](CCN5CCC(CCCC6CCN(CC6)CC[n+]7ccc8ccc9[nH]c%10ccc(OC)cc%10c9c8c7)CC5)cc4c3c2c1" 232 SMILES_CANONICAL "OpenEye OEToolkits" 1.5.0 "COc1ccc2c(c1)c3c([nH]2)ccc4c3c[n+](cc4)CCN5CCC(CC5)CCCC6CCN(CC6)CC[n+]7ccc8ccc9c(c8c7)c1cc(ccc1[nH]9)OC" 232 SMILES "OpenEye OEToolkits" 1.5.0 "COc1ccc2c(c1)c3c([nH]2)ccc4c3c[n+](cc4)CCN5CCC(CC5)CCCC6CCN(CC6)CC[n+]7ccc8ccc9c(c8c7)c1cc(ccc1[nH]9)OC" 232 InChI InChI 1.03 "InChI=1S/C49H54N6O2/c1-56-38-8-12-44-40(30-38)48-42-32-54(24-18-36(42)6-10-46(48)50-44)28-26-52-20-14-34(15-21-52)4-3-5-35-16-22-53(23-17-35)27-29-55-25-19-37-7-11-47-49(43(37)33-55)41-31-39(57-2)9-13-45(41)51-47/h6-13,18-19,24-25,30-35H,3-5,14-17,20-23,26-29H2,1-2H3/p+2" 232 InChIKey InChI 1.03 OAPSNAJHSNYHAG-UHFFFAOYSA-P # # 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 232 "SYSTEMATIC NAME" ACDLabs 10.04 "2,2'-[propane-1,3-diylbis(piperidine-4,1-diylethane-2,1-diyl)]bis(10-methoxy-7H-pyrido[4,3-c]carbazol-2-ium)" 232 "SYSTEMATIC NAME" "OpenEye OEToolkits" 1.5.0 "10-methoxy-2-[2-[4-[3-[1-[2-(10-methoxy-7H-pyrido[4,3-c]carbazol-2-ium-2-yl)ethyl]piperidin-4-yl]propyl]piperidin-1-yl]ethyl]-7H-pyrido[4,3-c]carbazol-2-ium" # # loop_ _pdbx_chem_comp_audit.comp_id _pdbx_chem_comp_audit.action_type _pdbx_chem_comp_audit.date _pdbx_chem_comp_audit.processing_site 232 "Create component" 1999-10-08 PDBJ 232 "Modify descriptor" 2011-06-04 RCSB 232 "Modify synonyms" 2020-06-05 PDBE # _pdbx_chem_comp_synonyms.ordinal 1 _pdbx_chem_comp_synonyms.comp_id 232 _pdbx_chem_comp_synonyms.name "BIS INTERCALATOR D232" _pdbx_chem_comp_synonyms.provenance ? _pdbx_chem_comp_synonyms.type ? ##