data_PRDCC_900072
# 
_chem_comp.id                                    PRD_900072 
_chem_comp.name                                  CELLOOCTAOSE 
_chem_comp.type                                  saccharide 
_chem_comp.formula                               "C48 H82 O41" 
_chem_comp.pdbx_release_status                   REF_ONLY 
_chem_comp.formula_weight                        1315.140 
_chem_comp.pdbx_type                             ? 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         ? 
_chem_comp.pdbx_formal_charge                    ? 
_chem_comp.pdbx_initial_date                     ? 
_chem_comp.pdbx_modified_date                    ? 
_chem_comp.pdbx_ambiguous_flag                   ? 
_chem_comp.pdbx_replaced_by                      ? 
_chem_comp.pdbx_replaces                         ? 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     ? 
_chem_comp.pdbx_model_coordinates_details        ? 
_chem_comp.pdbx_model_coordinates_missing_flag   ? 
_chem_comp.pdbx_ideal_coordinates_details        ? 
_chem_comp.pdbx_ideal_coordinates_missing_flag   ? 
_chem_comp.pdbx_model_coordinates_db_code        ? 
_chem_comp.pdbx_subcomponent_list                ? 
_chem_comp.pdbx_pcm                              ? 
_chem_comp.pdbx_processing_site                  ? 
# 
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_comp_id 
_chem_comp_atom.pdbx_residue_numbering 
_chem_comp_atom.pdbx_component_atom_id 
_chem_comp_atom.pdbx_polymer_type 
_chem_comp_atom.pdbx_ref_id 
_chem_comp_atom.pdbx_component_id 
_chem_comp_atom.pdbx_ordinal 
_chem_comp_atom.pdbx_backbone_atom_flag 
_chem_comp_atom.pdbx_n_terminal_atom_flag 
_chem_comp_atom.pdbx_c_terminal_atom_flag 
PRD_900072 C2A  C45 C 0 1 N N R -16.729 42.697 20.888 17.944  -0.533 -1.460 BGC 1 C2   polymer 1 1 1   ? ? ? 
PRD_900072 C3A  C44 C 0 1 N N R -15.593 42.253 19.971 16.647  0.209  -1.122 BGC 1 C3   polymer 1 1 2   ? ? ? 
PRD_900072 C4A  C43 C 0 1 N N S -14.572 41.391 20.723 16.429  0.169  0.393  BGC 1 C4   polymer 1 1 3   ? ? ? 
PRD_900072 C5A  C47 C 0 1 N N R -15.301 40.322 21.523 17.646  0.781  1.092  BGC 1 C5   polymer 1 1 4   ? ? ? 
PRD_900072 C6A  C48 C 0 1 N N N -14.298 39.534 22.368 17.462  0.691  2.609  BGC 1 C6   polymer 1 1 5   ? ? ? 
PRD_900072 C1A  C46 C 0 1 N N R -17.342 41.477 21.578 19.103  0.106  -0.689 BGC 1 C1   polymer 1 1 6   ? ? ? 
PRD_900072 O1A  O39 O 0 1 N N N -18.447 41.851 22.405 20.307  -0.616 -0.955 BGC 1 O1   polymer 1 1 7   ? ? ? 
PRD_900072 O2A  O38 O 0 1 N N N -17.730 43.354 20.101 18.196  -0.440 -2.863 BGC 1 O2   polymer 1 1 8   ? ? ? 
PRD_900072 O3A  O37 O 0 1 N N N -14.942 43.421 19.465 15.549  -0.426 -1.780 BGC 1 O3   polymer 1 1 9   ? ? ? 
PRD_900072 O4A  O36 O 0 1 N N N -13.697 40.713 19.807 15.259  0.920  0.727  BGC 1 O4   polymer 1 1 10  ? ? ? 
PRD_900072 O5A  O40 O 0 1 N N N -16.319 40.866 22.376 18.822  0.064  0.711  BGC 1 O5   polymer 1 1 11  ? ? ? 
PRD_900072 O6A  O41 O 0 1 N N N -15.003 38.572 23.156 18.541  1.364  3.260  BGC 1 O6   polymer 1 1 12  ? ? ? 
PRD_900072 C2B  C41 C 0 1 N N R -11.766 40.634 18.399 12.895  1.019  1.224  BGC 2 C2   polymer 1 1 13  ? ? ? 
PRD_900072 C3B  C40 C 0 1 N N R -10.753 41.462 17.610 11.600  0.203  1.175  BGC 2 C3   polymer 1 1 14  ? ? ? 
PRD_900072 C4B  C37 C 0 1 N N S -11.510 42.299 16.571 11.385  -0.307 -0.254 BGC 2 C4   polymer 1 1 15  ? ? ? 
PRD_900072 C5B  C38 C 0 1 N N R -12.405 43.183 17.431 12.604  -1.126 -0.683 BGC 2 C5   polymer 1 1 16  ? ? ? 
PRD_900072 C6B  C39 C 0 1 N N N -13.146 44.200 16.561 12.424  -1.589 -2.131 BGC 2 C6   polymer 1 1 17  ? ? ? 
PRD_900072 C1B  C42 C 0 1 N N S -12.737 41.549 19.137 14.057  0.148  0.737  BGC 2 C1   polymer 1 1 18  ? ? ? 
PRD_900072 O2B  O35 O 0 1 N N N -11.084 39.782 19.333 13.144  1.439  2.567  BGC 2 O2   polymer 1 1 19  ? ? ? 
PRD_900072 O3B  O34 O 0 1 N N N -9.808  40.588 16.990 10.499  1.030  1.558  BGC 2 O3   polymer 1 1 20  ? ? ? 
PRD_900072 O4B  O31 O 0 1 N N N -10.719 43.171 15.745 10.217  -1.130 -0.296 BGC 2 O4   polymer 1 1 21  ? ? ? 
PRD_900072 O5B  O32 O 0 1 N N N -13.366 42.409 18.168 13.779  -0.318 -0.585 BGC 2 O5   polymer 1 1 22  ? ? ? 
PRD_900072 O6B  O33 O 0 1 N N N -13.911 45.063 17.406 13.505  -2.450 -2.494 BGC 2 O6   polymer 1 1 23  ? ? ? 
PRD_900072 C2C  C35 C 0 1 N N R -9.151  41.640 14.535 7.855   -1.407 -0.727 BGC 3 C2   polymer 1 1 24  ? ? ? 
PRD_900072 C3C  C34 C 0 1 N N R -7.654  41.370 14.401 6.558   -0.631 -0.977 BGC 3 C3   polymer 1 1 25  ? ? ? 
PRD_900072 C4C  C31 C 0 1 N N S -6.956  42.592 13.790 6.339   0.360  0.171  BGC 3 C4   polymer 1 1 26  ? ? ? 
PRD_900072 C5C  C32 C 0 1 N N R -7.396  43.850 14.523 7.556   1.282  0.278  BGC 3 C5   polymer 1 1 27  ? ? ? 
PRD_900072 C6C  C33 C 0 1 N N N -6.933  45.063 13.719 7.372   2.235  1.461  BGC 3 C6   polymer 1 1 28  ? ? ? 
PRD_900072 C1C  C36 C 0 1 N N S -9.347  42.822 15.479 9.013   -0.416 -0.585 BGC 3 C1   polymer 1 1 29  ? ? ? 
PRD_900072 O2C  O30 O 0 1 N N N -9.804  40.463 15.031 8.107   -2.282 -1.828 BGC 3 O2   polymer 1 1 30  ? ? ? 
PRD_900072 O3C  O29 O 0 1 N N N -7.438  40.229 13.570 5.459   -1.542 -1.038 BGC 3 O3   polymer 1 1 31  ? ? ? 
PRD_900072 O4C  O26 O 0 1 N N N -5.530  42.469 13.900 5.170   1.140  -0.088 BGC 3 O4   polymer 1 1 32  ? ? ? 
PRD_900072 O5C  O27 O 0 1 N N N -8.812  43.936 14.747 8.732   0.495  0.479  BGC 3 O5   polymer 1 1 33  ? ? ? 
PRD_900072 O6C  O28 O 0 1 N N N -7.411  46.264 14.339 8.451   3.171  1.492  BGC 3 O6   polymer 1 1 34  ? ? ? 
PRD_900072 C2D  C29 C 0 1 N N R -3.509  43.462 13.030 2.805   1.545  0.206  BGC 4 C2   polymer 1 1 35  ? ? ? 
PRD_900072 C3D  C28 C 0 1 N N R -2.666  43.681 11.770 1.508   0.905  0.710  BGC 4 C3   polymer 1 1 36  ? ? ? 
PRD_900072 C4D  C25 C 0 1 N N S -2.449  42.346 11.057 1.296   -0.430 -0.011 BGC 4 C4   polymer 1 1 37  ? ? ? 
PRD_900072 C5D  C26 C 0 1 N N R -3.839  41.812 10.751 2.516   -1.326 0.223  BGC 4 C5   polymer 1 1 38  ? ? ? 
PRD_900072 C6D  C27 C 0 1 N N N -3.717  40.516 9.946  2.339   -2.639 -0.543 BGC 4 C6   polymer 1 1 39  ? ? ? 
PRD_900072 C1D  C30 C 0 1 N N S -4.838  42.781 12.681 3.966   0.572  0.431  BGC 4 C1   polymer 1 1 40  ? ? ? 
PRD_900072 O2D  O25 O 0 1 N N N -3.775  44.722 13.644 3.050   2.756  0.924  BGC 4 O2   polymer 1 1 41  ? ? ? 
PRD_900072 O3D  O24 O 0 1 N N N -1.414  44.264 12.136 0.408   1.775  0.438  BGC 4 O3   polymer 1 1 42  ? ? ? 
PRD_900072 O4D  O21 O 0 1 N N N -1.778  42.487 9.793  0.127   -1.071 0.504  BGC 4 O4   polymer 1 1 43  ? ? ? 
PRD_900072 O5D  O22 O 0 1 N N N -4.588  41.569 11.955 3.691   -0.659 -0.240 BGC 4 O5   polymer 1 1 44  ? ? ? 
PRD_900072 O6D  O23 O 0 1 N N N -5.020  40.068 9.565  3.419   -3.521 -0.234 BGC 4 O6   polymer 1 1 45  ? ? ? 
PRD_900072 C2E  C23 C 0 1 N N R 0.347   41.941 11.027 -2.236  -1.561 0.363  BGC 5 C2   polymer 1 1 46  ? ? ? 
PRD_900072 C3E  C22 C 0 1 N N R 1.864   42.103 10.864 -3.531  -1.147 -0.342 BGC 5 C3   polymer 1 1 47  ? ? ? 
PRD_900072 C4E  C19 C 0 1 N N S 2.343   41.389 9.596  -3.748  0.357  -0.145 BGC 5 C4   polymer 1 1 48  ? ? ? 
PRD_900072 C5E  C20 C 0 1 N N R 1.488   41.833 8.419  -2.529  1.114  -0.677 BGC 5 C5   polymer 1 1 49  ? ? ? 
PRD_900072 C6E  C21 C 0 1 N N N 1.839   40.967 7.208  -2.712  2.613  -0.429 BGC 5 C6   polymer 1 1 50  ? ? ? 
PRD_900072 C1E  C24 C 0 1 N N S -0.341  42.536 9.797  -1.075  -0.729 -0.188 BGC 5 C1   polymer 1 1 51  ? ? ? 
PRD_900072 O2E  O20 O 0 1 N N N -0.067  42.626 12.208 -1.985  -2.948 0.125  BGC 5 O2   polymer 1 1 52  ? ? ? 
PRD_900072 O3E  O19 O 0 1 N N N 2.522   41.572 12.013 -4.632  -1.866 0.218  BGC 5 O3   polymer 1 1 53  ? ? ? 
PRD_900072 O4E  O16 O 0 1 N N N 3.717   41.680 9.283  -4.916  0.768  -0.859 BGC 5 O4   polymer 1 1 54  ? ? ? 
PRD_900072 O5E  O17 O 0 1 N N N 0.074   41.751 8.669  -1.355  0.659  -0.001 BGC 5 O5   polymer 1 1 55  ? ? ? 
PRD_900072 O6E  O18 O 0 1 N N N 0.931   41.248 6.137  -1.630  3.330  -1.027 BGC 5 O6   polymer 1 1 56  ? ? ? 
PRD_900072 C2F  C17 C 0 1 N N R 5.553   40.098 9.617  -7.280  1.270  -0.912 BGC 6 C2   polymer 1 1 57  ? ? ? 
PRD_900072 C3F  C16 C 0 1 N N R 6.814   40.733 9.019  -8.578  1.130  -0.111 BGC 6 C3   polymer 1 1 58  ? ? ? 
PRD_900072 C4F  C13 C 0 1 N N S 6.483   42.103 8.433  -8.793  -0.346 0.238  BGC 6 C4   polymer 1 1 59  ? ? ? 
PRD_900072 C5F  C14 C 0 1 N N R 6.049   42.985 9.591  -7.576  -0.862 1.010  BGC 6 C5   polymer 1 1 60  ? ? ? 
PRD_900072 C6F  C15 C 0 1 N N N 5.125   44.096 9.080  -7.756  -2.351 1.310  BGC 6 C6   polymer 1 1 61  ? ? ? 
PRD_900072 C1F  C18 C 0 1 N N S 4.646   41.160 10.248 -6.121  0.692  -0.095 BGC 6 C1   polymer 1 1 62  ? ? ? 
PRD_900072 O2F  O15 O 0 1 N N N 5.940   39.155 10.615 -7.032  2.652  -1.181 BGC 6 O2   polymer 1 1 63  ? ? ? 
PRD_900072 O3F  O14 O 0 1 N N N 7.340   39.884 7.997  -9.676  1.601  -0.895 BGC 6 O3   polymer 1 1 64  ? ? ? 
PRD_900072 O4F  O11 O 0 1 N N N 7.602   42.707 7.762  -9.963  -0.480 1.047  BGC 6 O4   polymer 1 1 65  ? ? ? 
PRD_900072 O5F  O12 O 0 1 N N N 5.478   42.248 10.684 -6.399  -0.674 0.222  BGC 6 O5   polymer 1 1 66  ? ? ? 
PRD_900072 O6F  O13 O 0 1 N N N 4.699   44.900 10.180 -6.677  -2.806 2.130  BGC 6 O6   polymer 1 1 67  ? ? ? 
PRD_900072 C2G  C11 C 0 1 N N R 7.402   43.848 5.641  -12.328 -0.935 1.264  BGC 7 C2   polymer 1 1 68  ? ? ? 
PRD_900072 C3G  C10 C 0 1 N N R 7.273   43.631 4.130  -13.622 -1.092 0.461  BGC 7 C3   polymer 1 1 69  ? ? ? 
PRD_900072 C4G  C7  C 0 1 N N S 8.443   42.795 3.613  -13.836 0.162  -0.392 BGC 7 C4   polymer 1 1 70  ? ? ? 
PRD_900072 C5G  C8  C 0 1 N N R 8.667   41.568 4.482  -12.615 0.372  -1.292 BGC 7 C5   polymer 1 1 71  ? ? ? 
PRD_900072 C6G  C9  C 0 1 N N N 9.951   40.872 4.032  -12.794 1.656  -2.104 BGC 7 C6   polymer 1 1 72  ? ? ? 
PRD_900072 C1G  C12 C 0 1 N N S 7.535   42.501 6.340  -11.165 -0.683 0.301  BGC 7 C1   polymer 1 1 73  ? ? ? 
PRD_900072 O2G  O10 O 0 1 N N N 6.235   44.525 6.123  -12.080 -2.129 2.009  BGC 7 O2   polymer 1 1 74  ? ? ? 
PRD_900072 O3G  O9  O 0 1 N N N 7.265   44.900 3.471  -14.724 -1.254 1.356  BGC 7 O3   polymer 1 1 75  ? ? ? 
PRD_900072 O4G  O6  O 0 1 N N N 8.193   42.395 2.258  -15.002 -0.003 -1.201 BGC 7 O4   polymer 1 1 76  ? ? ? 
PRD_900072 O5G  O7  O 0 1 N N N 8.756   41.904 5.875  -11.442 0.479  -0.483 BGC 7 O5   polymer 1 1 77  ? ? ? 
PRD_900072 O6G  O8  O 0 1 N N N 10.191  39.717 4.841  -11.712 1.791  -3.027 BGC 7 O6   polymer 1 1 78  ? ? ? 
PRD_900072 C2H  C1  C 0 1 N N R 8.755   42.592 -0.071 -17.365 0.341  -1.578 BGC 8 C2   polymer 1 1 79  ? ? ? 
PRD_900072 C3H  C2  C 0 1 N N S 9.592   43.361 -1.089 -18.664 0.771  -0.889 BGC 8 C3   polymer 1 1 80  ? ? ? 
PRD_900072 C4H  C3  C 0 1 N N S 9.338   44.860 -0.924 -18.882 -0.098 0.354  BGC 8 C4   polymer 1 1 81  ? ? ? 
PRD_900072 C5H  C4  C 0 1 N N R 9.580   45.270 0.533  -17.666 0.028  1.275  BGC 8 C5   polymer 1 1 82  ? ? ? 
PRD_900072 C6H  C5  C 0 1 N N N 9.314   46.768 0.702  -17.849 -0.884 2.489  BGC 8 C6   polymer 1 1 83  ? ? ? 
PRD_900072 C1H  C6  C 0 1 N N S 9.022   43.123 1.342  -16.208 0.450  -0.582 BGC 8 C1   polymer 1 1 84  ? ? ? 
PRD_900072 O2H  O1  O 0 1 N N N 9.075   41.200 -0.125 -17.114 1.193  -2.697 BGC 8 O2   polymer 1 1 85  ? ? ? 
PRD_900072 O3H  O2  O 0 1 N N N 9.207   42.971 -2.413 -19.761 0.603  -1.788 BGC 8 O3   polymer 1 1 86  ? ? ? 
PRD_900072 O4H  O3  O 0 1 N N N 10.215  45.589 -1.785 -20.053 0.342  1.045  BGC 8 O4   polymer 1 1 87  ? ? ? 
PRD_900072 O5H  O5  O 0 1 N N N 8.710   44.523 1.395  -16.489 -0.358 0.563  BGC 8 O5   polymer 1 1 88  ? ? ? 
PRD_900072 O6H  O4  O 0 1 N N N 7.955   47.058 0.367  -16.771 -0.681 3.405  BGC 8 O6   polymer 1 1 89  ? ? ? 
PRD_900072 H2A  H75 H 0 1 N N N -16.330 43.381 21.652 17.850  -1.580 -1.174 BGC 1 H2   polymer 1 1 90  ? ? ? 
PRD_900072 H3A  H73 H 0 1 N N N -16.013 41.663 19.143 16.722  1.245  -1.453 BGC 1 H3   polymer 1 1 91  ? ? ? 
PRD_900072 H4A  H72 H 0 1 N N N -13.995 42.029 21.408 16.303  -0.864 0.718  BGC 1 H4   polymer 1 1 92  ? ? ? 
PRD_900072 H5A  H79 H 0 1 N N N -15.764 39.623 20.811 17.746  1.826  0.800  BGC 1 H5   polymer 1 1 93  ? ? ? 
PRD_900072 H6A1 H80 H 0 1 N N N -13.585 39.018 21.708 16.519  1.160  2.889  BGC 1 H6C1 polymer 1 1 94  ? ? ? 
PRD_900072 H6A2 H81 H 0 1 N N N -13.752 40.223 23.029 17.451  -0.356 2.912  BGC 1 H6C2 polymer 1 1 95  ? ? ? 
PRD_900072 H1A  H77 H 0 1 N N N -17.679 40.772 20.804 19.222  1.142  -1.005 BGC 1 H1   polymer 1 1 96  ? ? ? 
PRD_900072 HO1A H78 H 0 1 N N N -18.808 41.077 22.821 21.084  -0.266 -0.499 BGC 1 HA   polymer 1 1 97  ? ? ? 
PRD_900072 HO2A H76 H 0 1 N N N -18.442 43.634 20.664 19.004  -0.889 -3.148 BGC 1 HB   polymer 1 1 98  ? ? ? 
PRD_900072 HO3A H74 H 0 1 N N N -15.572 43.958 18.998 15.621  -0.438 -2.744 BGC 1 HC   polymer 1 1 99  ? ? ? 
PRD_900072 HO6A H82 H 0 1 N N N -14.385 38.079 23.683 18.490  1.347  4.226  BGC 1 H6   polymer 1 1 100 ? ? ? 
PRD_900072 H2B  H69 H 0 1 N N N -12.339 40.019 17.689 12.800  1.893  0.580  BGC 2 H2   polymer 1 1 101 ? ? ? 
PRD_900072 H3B  H67 H 0 1 N N N -10.238 42.144 18.303 11.676  -0.644 1.857  BGC 2 H3   polymer 1 1 102 ? ? ? 
PRD_900072 H4B  H62 H 0 1 N N N -12.133 41.636 15.952 11.259  0.540  -0.928 BGC 2 H4   polymer 1 1 103 ? ? ? 
PRD_900072 H5B  H63 H 0 1 N N N -11.766 43.736 18.135 12.706  -1.996 -0.034 BGC 2 H5   polymer 1 1 104 ? ? ? 
PRD_900072 H6B1 H64 H 0 1 N N N -13.817 43.673 15.867 11.482  -2.130 -2.224 BGC 2 H6C1 polymer 1 1 105 ? ? ? 
PRD_900072 H6B2 H65 H 0 1 N N N -12.419 44.794 15.988 12.412  -0.722 -2.791 BGC 2 H6C2 polymer 1 1 106 ? ? ? 
PRD_900072 H1B  H71 H 0 1 N N N -12.178 42.149 19.870 14.177  -0.704 1.406  BGC 2 H1   polymer 1 1 107 ? ? ? 
PRD_900072 HO2B H70 H 0 1 N N N -11.720 39.271 19.819 13.951  1.962  2.672  BGC 2 HB   polymer 1 1 108 ? ? ? 
PRD_900072 HO3B H68 H 0 1 N N N -9.356  40.085 17.657 10.569  1.388  2.453  BGC 2 HC   polymer 1 1 109 ? ? ? 
PRD_900072 HO6B H66 H 0 1 N N N -14.375 45.698 16.874 13.456  -2.782 -3.401 BGC 2 H6   polymer 1 1 110 ? ? ? 
PRD_900072 H2C  H59 H 0 1 N N N -9.553  41.906 13.546 7.759   -1.991 0.188  BGC 3 H2   polymer 1 1 111 ? ? ? 
PRD_900072 H3C  H57 H 0 1 N N N -7.237  41.192 15.403 6.634   -0.086 -1.918 BGC 3 H3   polymer 1 1 112 ? ? ? 
PRD_900072 H4C  H52 H 0 1 N N N -7.248  42.674 12.733 6.212   -0.188 1.105  BGC 3 H4   polymer 1 1 113 ? ? ? 
PRD_900072 H5C  H53 H 0 1 N N N -6.879  43.873 15.494 7.658   1.858  -0.641 BGC 3 H5   polymer 1 1 114 ? ? ? 
PRD_900072 H6C1 H54 H 0 1 N N N -7.330  44.997 12.695 6.429   2.771  1.352  BGC 3 H6C1 polymer 1 1 115 ? ? ? 
PRD_900072 H6C2 H55 H 0 1 N N N -5.834  45.081 13.685 7.360   1.663  2.389  BGC 3 H6C2 polymer 1 1 116 ? ? ? 
PRD_900072 H1C  H61 H 0 1 N N N -8.791  42.654 16.413 9.134   0.138  -1.516 BGC 3 H1   polymer 1 1 117 ? ? ? 
PRD_900072 HO2C H60 H 0 1 N N N -10.736 40.629 15.115 8.915   -2.806 -1.737 BGC 3 HB   polymer 1 1 118 ? ? ? 
PRD_900072 HO3C H58 H 0 1 N N N -7.871  39.473 13.950 5.532   -2.199 -1.744 BGC 3 HC   polymer 1 1 119 ? ? ? 
PRD_900072 HO6C H56 H 0 1 N N N -7.122  47.017 13.837 8.399   3.807  2.217  BGC 3 H6   polymer 1 1 120 ? ? ? 
PRD_900072 H2D  H49 H 0 1 N N N -2.950  42.813 13.721 2.713   1.764  -0.858 BGC 4 H2   polymer 1 1 121 ? ? ? 
PRD_900072 H3D  H47 H 0 1 N N N -3.212  44.356 11.095 1.578   0.732  1.784  BGC 4 H3   polymer 1 1 122 ? ? ? 
PRD_900072 H4D  H42 H 0 1 N N N -1.913  41.649 11.718 1.173   -0.252 -1.079 BGC 4 H4   polymer 1 1 123 ? ? ? 
PRD_900072 H5D  H43 H 0 1 N N N -4.367  42.553 10.133 2.613   -1.537 1.288  BGC 4 H5   polymer 1 1 124 ? ? ? 
PRD_900072 H6D1 H44 H 0 1 N N N -3.230  39.746 10.562 1.396   -3.104 -0.255 BGC 4 H6C1 polymer 1 1 125 ? ? ? 
PRD_900072 H6D2 H45 H 0 1 N N N -3.114  40.700 9.044  2.331   -2.436 -1.614 BGC 4 H6C2 polymer 1 1 126 ? ? ? 
PRD_900072 H1D  H51 H 0 1 N N N -5.440  43.471 12.071 4.082   0.386  1.499  BGC 4 H1   polymer 1 1 127 ? ? ? 
PRD_900072 HO2D H50 H 0 1 N N N -4.298  44.590 14.426 3.858   3.215  0.656  BGC 4 HB   polymer 1 1 128 ? ? ? 
PRD_900072 HO3D H48 H 0 1 N N N -1.566  45.091 12.577 0.476   2.640  0.863  BGC 4 HC   polymer 1 1 129 ? ? ? 
PRD_900072 HO6D H46 H 0 1 N N N -4.945  39.264 9.065  3.372   -4.374 -0.685 BGC 4 H6   polymer 1 1 130 ? ? ? 
PRD_900072 H2E  H39 H 0 1 N N N 0.104   40.870 11.095 -2.333  -1.388 1.435  BGC 5 H2   polymer 1 1 131 ? ? ? 
PRD_900072 H3E  H37 H 0 1 N N N 2.090   43.175 10.766 -3.454  -1.367 -1.406 BGC 5 H3   polymer 1 1 132 ? ? ? 
PRD_900072 H4E  H32 H 0 1 N N N 2.215   40.305 9.735  -3.876  0.570  0.917  BGC 5 H4   polymer 1 1 133 ? ? ? 
PRD_900072 H5E  H33 H 0 1 N N N 1.752   42.874 8.179  -2.427  0.933  -1.746 BGC 5 H5   polymer 1 1 134 ? ? ? 
PRD_900072 H6E1 H34 H 0 1 N N N 1.763   39.905 7.483  -3.653  2.942  -0.869 BGC 5 H6C1 polymer 1 1 135 ? ? ? 
PRD_900072 H6E2 H35 H 0 1 N N N 2.867   41.189 6.885  -2.726  2.805  0.644  BGC 5 H6C2 polymer 1 1 136 ? ? ? 
PRD_900072 H1E  H41 H 0 1 N N N -0.003  43.575 9.674  -0.954  -0.935 -1.252 BGC 5 H1   polymer 1 1 137 ? ? ? 
PRD_900072 HO2E H40 H 0 1 N N N 0.367   42.247 12.963 -1.179  -3.279 0.543  BGC 5 HB   polymer 1 1 138 ? ? ? 
PRD_900072 HO3E H38 H 0 1 N N N 2.216   42.023 12.791 -4.560  -2.826 0.129  BGC 5 HC   polymer 1 1 139 ? ? ? 
PRD_900072 HO6E H36 H 0 1 N N N 1.150   40.709 5.386  -1.681  4.289  -0.909 BGC 5 H6   polymer 1 1 140 ? ? ? 
PRD_900072 H2F  H29 H 0 1 N N N 4.998   39.593 8.813  -7.371  0.726  -1.852 BGC 6 H2   polymer 1 1 141 ? ? ? 
PRD_900072 H3F  H27 H 0 1 N N N 7.556   40.862 9.821  -8.506  1.715  0.806  BGC 6 H3   polymer 1 1 142 ? ? ? 
PRD_900072 H4F  H22 H 0 1 N N N 5.641   41.994 7.734  -8.916  -0.923 -0.679 BGC 6 H4   polymer 1 1 143 ? ? ? 
PRD_900072 H5F  H23 H 0 1 N N N 6.956   43.482 9.964  -7.479  -0.311 1.946  BGC 6 H5   polymer 1 1 144 ? ? ? 
PRD_900072 H6F1 H24 H 0 1 N N N 5.668   44.722 8.356  -8.700  -2.505 1.834  BGC 6 H6C1 polymer 1 1 145 ? ? ? 
PRD_900072 H6F2 H25 H 0 1 N N N 4.247   43.648 8.591  -7.764  -2.912 0.375  BGC 6 H6C2 polymer 1 1 146 ? ? ? 
PRD_900072 H1F  H31 H 0 1 N N N 4.110   40.718 11.101 -6.005  1.263  0.826  BGC 6 H1   polymer 1 1 147 ? ? ? 
PRD_900072 HO2F H30 H 0 1 N N N 5.165   38.756 10.992 -6.223  2.815  -1.686 BGC 6 HB   polymer 1 1 148 ? ? ? 
PRD_900072 HO3F H28 H 0 1 N N N 7.545   39.033 8.366  -9.606  2.530  -1.153 BGC 6 HC   polymer 1 1 149 ? ? ? 
PRD_900072 HO6F H26 H 0 1 N N N 4.126   45.589 9.866  -6.727  -3.744 2.360  BGC 6 H6   polymer 1 1 150 ? ? ? 
PRD_900072 H2G  H19 H 0 1 N N N 8.302   44.448 5.841  -12.424 -0.092 1.949  BGC 7 H2   polymer 1 1 151 ? ? ? 
PRD_900072 H3G  H17 H 0 1 N N N 6.335   43.093 3.928  -13.545 -1.965 -0.188 BGC 7 H3   polymer 1 1 152 ? ? ? 
PRD_900072 H4G  H12 H 0 1 N N N 9.351   43.415 3.650  -13.963 1.028  0.258  BGC 7 H4   polymer 1 1 153 ? ? ? 
PRD_900072 H5G  H13 H 0 1 N N N 7.827   40.875 4.325  -12.513 -0.475 -1.970 BGC 7 H5   polymer 1 1 154 ? ? ? 
PRD_900072 H6G1 H14 H 0 1 N N N 9.850   40.566 2.980  -13.735 1.612  -2.652 BGC 7 H6C1 polymer 1 1 155 ? ? ? 
PRD_900072 H6G2 H15 H 0 1 N N N 10.797  41.568 4.131  -12.807 2.513  -1.431 BGC 7 H6C2 polymer 1 1 156 ? ? ? 
PRD_900072 H1G  H21 H 0 1 N N N 6.673   41.869 6.081  -11.044 -1.544 -0.356 BGC 7 H1   polymer 1 1 157 ? ? ? 
PRD_900072 HO2G H20 H 0 1 N N N 6.312   44.661 7.060  -11.274 -2.100 2.543  BGC 7 HB   polymer 1 1 158 ? ? ? 
PRD_900072 HO3G H18 H 0 1 N N N 6.538   45.420 3.792  -14.655 -2.031 1.928  BGC 7 HC   polymer 1 1 159 ? ? ? 
PRD_900072 HO6G H16 H 0 1 N N N 10.990  39.290 4.555  -11.760 2.586  -3.576 BGC 7 H6   polymer 1 1 160 ? ? ? 
PRD_900072 H2H  H2  H 0 1 N N N 7.691   42.742 -0.306 -17.457 -0.690 -1.918 BGC 8 H2   polymer 1 1 161 ? ? ? 
PRD_900072 H3H  H3  H 0 1 N N N 10.658  43.152 -0.917 -18.590 1.818  -0.593 BGC 8 H3   polymer 1 1 162 ? ? ? 
PRD_900072 H4H  H5  H 0 1 N N N 8.290   45.073 -1.182 -19.005 -1.138 0.053  BGC 8 H4   polymer 1 1 163 ? ? ? 
PRD_900072 H5H  H7  H 0 1 N N N 10.630  45.066 0.788  -17.567 1.061  1.608  BGC 8 H5   polymer 1 1 164 ? ? ? 
PRD_900072 H6H1 H8  H 0 1 N N N 9.983   47.335 0.038  -18.793 -0.649 2.981  BGC 8 H6C1 polymer 1 1 165 ? ? ? 
PRD_900072 H6H2 H9  H 0 1 N N N 9.503   47.057 1.746  -17.858 -1.925 2.164  BGC 8 H6C2 polymer 1 1 166 ? ? ? 
PRD_900072 H1H  H11 H 0 1 N N N 10.083  42.964 1.585  -16.090 1.489  -0.273 BGC 8 H1   polymer 1 1 167 ? ? ? 
PRD_900072 HO2H H1  H 0 1 N N N 8.550   40.729 0.511  -16.303 0.981  -3.179 BGC 8 HB   polymer 1 1 168 ? ? ? 
PRD_900072 HO3H H4  H 0 1 N N N 9.361   42.040 -2.527 -19.689 1.126  -2.599 BGC 8 HC   polymer 1 1 169 ? ? ? 
PRD_900072 HO4H H6  H 0 1 N N N 10.058  46.520 -1.683 -20.862 0.294  0.518  BGC 8 HD   polymer 1 1 170 ? ? ? 
PRD_900072 HO6H H10 H 0 1 N N N 7.794   47.988 0.473  -16.823 -1.228 4.201  BGC 8 H6   polymer 1 1 171 ? ? ? 
# 
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 
PRD_900072 O3H C3H  SING N N 1   
PRD_900072 O4H C4H  SING N N 2   
PRD_900072 C3H C4H  SING N N 3   
PRD_900072 C3H C2H  SING N N 4   
PRD_900072 C4H C5H  SING N N 5   
PRD_900072 O2H C2H  SING N N 6   
PRD_900072 C2H C1H  SING N N 7   
PRD_900072 O6H C6H  SING N N 8   
PRD_900072 C5H C6H  SING N N 9   
PRD_900072 C5H O5H  SING N N 10  
PRD_900072 C1H O5H  SING N N 11  
PRD_900072 C1H O4G  SING N N 12  
PRD_900072 O4G C4G  SING N N 13  
PRD_900072 O3G C3G  SING N N 14  
PRD_900072 C4G C3G  SING N N 15  
PRD_900072 C4G C5G  SING N N 16  
PRD_900072 C6G C5G  SING N N 17  
PRD_900072 C6G O6G  SING N N 18  
PRD_900072 C3G C2G  SING N N 19  
PRD_900072 C5G O5G  SING N N 20  
PRD_900072 C2G O2G  SING N N 21  
PRD_900072 C2G C1G  SING N N 22  
PRD_900072 O5G C1G  SING N N 23  
PRD_900072 O6E C6E  SING N N 24  
PRD_900072 C1G O4F  SING N N 25  
PRD_900072 C6E C5E  SING N N 26  
PRD_900072 O4F C4F  SING N N 27  
PRD_900072 O3F C3F  SING N N 28  
PRD_900072 C5E O5E  SING N N 29  
PRD_900072 C5E C4E  SING N N 30  
PRD_900072 C4F C3F  SING N N 31  
PRD_900072 C4F C5F  SING N N 32  
PRD_900072 O5E C1E  SING N N 33  
PRD_900072 C3F C2F  SING N N 34  
PRD_900072 C6F C5F  SING N N 35  
PRD_900072 C6F O6F  SING N N 36  
PRD_900072 O4E C4E  SING N N 37  
PRD_900072 O4E C1F  SING N N 38  
PRD_900072 O6D C6D  SING N N 39  
PRD_900072 C5F O5F  SING N N 40  
PRD_900072 C4E C3E  SING N N 41  
PRD_900072 C2F C1F  SING N N 42  
PRD_900072 C2F O2F  SING N N 43  
PRD_900072 O4D C1E  SING N N 44  
PRD_900072 O4D C4D  SING N N 45  
PRD_900072 C1E C2E  SING N N 46  
PRD_900072 C6D C5D  SING N N 47  
PRD_900072 C1F O5F  SING N N 48  
PRD_900072 C5D C4D  SING N N 49  
PRD_900072 C5D O5D  SING N N 50  
PRD_900072 C3E C2E  SING N N 51  
PRD_900072 C3E O3E  SING N N 52  
PRD_900072 C2E O2E  SING N N 53  
PRD_900072 C4D C3D  SING N N 54  
PRD_900072 C3D O3D  SING N N 55  
PRD_900072 C3D C2D  SING N N 56  
PRD_900072 O5D C1D  SING N N 57  
PRD_900072 C1D C2D  SING N N 58  
PRD_900072 C1D O4C  SING N N 59  
PRD_900072 C2D O2D  SING N N 60  
PRD_900072 O3C C3C  SING N N 61  
PRD_900072 C6C O6C  SING N N 62  
PRD_900072 C6C C5C  SING N N 63  
PRD_900072 C4C O4C  SING N N 64  
PRD_900072 C4C C3C  SING N N 65  
PRD_900072 C4C C5C  SING N N 66  
PRD_900072 C3C C2C  SING N N 67  
PRD_900072 C5C O5C  SING N N 68  
PRD_900072 C2C O2C  SING N N 69  
PRD_900072 C2C C1C  SING N N 70  
PRD_900072 O5C C1C  SING N N 71  
PRD_900072 C1C O4B  SING N N 72  
PRD_900072 O4B C4B  SING N N 73  
PRD_900072 C6B O6B  SING N N 74  
PRD_900072 C6B C5B  SING N N 75  
PRD_900072 C4B C5B  SING N N 76  
PRD_900072 C4B C3B  SING N N 77  
PRD_900072 O3B C3B  SING N N 78  
PRD_900072 C5B O5B  SING N N 79  
PRD_900072 C3B C2B  SING N N 80  
PRD_900072 O5B C1B  SING N N 81  
PRD_900072 C2B C1B  SING N N 82  
PRD_900072 C2B O2B  SING N N 83  
PRD_900072 C1B O4A  SING N N 84  
PRD_900072 O3A C3A  SING N N 85  
PRD_900072 O4A C4A  SING N N 86  
PRD_900072 C3A C4A  SING N N 87  
PRD_900072 C3A C2A  SING N N 88  
PRD_900072 O2A C2A  SING N N 89  
PRD_900072 C4A C5A  SING N N 90  
PRD_900072 C2A C1A  SING N N 91  
PRD_900072 C5A C6A  SING N N 92  
PRD_900072 C5A O5A  SING N N 93  
PRD_900072 C1A O5A  SING N N 94  
PRD_900072 C1A O1A  SING N N 95  
PRD_900072 C6A O6A  SING N N 96  
PRD_900072 O2H HO2H SING N N 97  
PRD_900072 C2H H2H  SING N N 98  
PRD_900072 C3H H3H  SING N N 99  
PRD_900072 O3H HO3H SING N N 100 
PRD_900072 C4H H4H  SING N N 101 
PRD_900072 O4H HO4H SING N N 102 
PRD_900072 C5H H5H  SING N N 103 
PRD_900072 C6H H6H1 SING N N 104 
PRD_900072 C6H H6H2 SING N N 105 
PRD_900072 O6H HO6H SING N N 106 
PRD_900072 C1H H1H  SING N N 107 
PRD_900072 C4G H4G  SING N N 108 
PRD_900072 C5G H5G  SING N N 109 
PRD_900072 C6G H6G1 SING N N 110 
PRD_900072 C6G H6G2 SING N N 111 
PRD_900072 O6G HO6G SING N N 112 
PRD_900072 C3G H3G  SING N N 113 
PRD_900072 O3G HO3G SING N N 114 
PRD_900072 C2G H2G  SING N N 115 
PRD_900072 O2G HO2G SING N N 116 
PRD_900072 C1G H1G  SING N N 117 
PRD_900072 C4F H4F  SING N N 118 
PRD_900072 C5F H5F  SING N N 119 
PRD_900072 C6F H6F1 SING N N 120 
PRD_900072 C6F H6F2 SING N N 121 
PRD_900072 O6F HO6F SING N N 122 
PRD_900072 C3F H3F  SING N N 123 
PRD_900072 O3F HO3F SING N N 124 
PRD_900072 C2F H2F  SING N N 125 
PRD_900072 O2F HO2F SING N N 126 
PRD_900072 C1F H1F  SING N N 127 
PRD_900072 C4E H4E  SING N N 128 
PRD_900072 C5E H5E  SING N N 129 
PRD_900072 C6E H6E1 SING N N 130 
PRD_900072 C6E H6E2 SING N N 131 
PRD_900072 O6E HO6E SING N N 132 
PRD_900072 C3E H3E  SING N N 133 
PRD_900072 O3E HO3E SING N N 134 
PRD_900072 C2E H2E  SING N N 135 
PRD_900072 O2E HO2E SING N N 136 
PRD_900072 C1E H1E  SING N N 137 
PRD_900072 C4D H4D  SING N N 138 
PRD_900072 C5D H5D  SING N N 139 
PRD_900072 C6D H6D1 SING N N 140 
PRD_900072 C6D H6D2 SING N N 141 
PRD_900072 O6D HO6D SING N N 142 
PRD_900072 C3D H3D  SING N N 143 
PRD_900072 O3D HO3D SING N N 144 
PRD_900072 C2D H2D  SING N N 145 
PRD_900072 O2D HO2D SING N N 146 
PRD_900072 C1D H1D  SING N N 147 
PRD_900072 C4C H4C  SING N N 148 
PRD_900072 C5C H5C  SING N N 149 
PRD_900072 C6C H6C1 SING N N 150 
PRD_900072 C6C H6C2 SING N N 151 
PRD_900072 O6C HO6C SING N N 152 
PRD_900072 C3C H3C  SING N N 153 
PRD_900072 O3C HO3C SING N N 154 
PRD_900072 C2C H2C  SING N N 155 
PRD_900072 O2C HO2C SING N N 156 
PRD_900072 C1C H1C  SING N N 157 
PRD_900072 C4B H4B  SING N N 158 
PRD_900072 C5B H5B  SING N N 159 
PRD_900072 C6B H6B1 SING N N 160 
PRD_900072 C6B H6B2 SING N N 161 
PRD_900072 O6B HO6B SING N N 162 
PRD_900072 C3B H3B  SING N N 163 
PRD_900072 O3B HO3B SING N N 164 
PRD_900072 C2B H2B  SING N N 165 
PRD_900072 O2B HO2B SING N N 166 
PRD_900072 C1B H1B  SING N N 167 
PRD_900072 C4A H4A  SING N N 168 
PRD_900072 C3A H3A  SING N N 169 
PRD_900072 O3A HO3A SING N N 170 
PRD_900072 C2A H2A  SING N N 171 
PRD_900072 O2A HO2A SING N N 172 
PRD_900072 C1A H1A  SING N N 173 
PRD_900072 O1A HO1A SING N N 174 
PRD_900072 C5A H5A  SING N N 175 
PRD_900072 C6A H6A1 SING N N 176 
PRD_900072 C6A H6A2 SING N N 177 
PRD_900072 O6A HO6A SING N N 178 
# 
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 
PRD_900072 SMILES           ACDLabs              12.01 
;OC1C(OC(C(C1O)O)CO)OC2C(C(O)C(OC2CO)OC3C(C(C(OC3CO)OC4C(C(O)C(OC4CO)OC5C(O)C(O)C(OC5CO)OC6C(C(O)C(OC6CO)OC7C(OC(C(C7O)O
 )OC8C(OC(C(C8O)O)O)CO)CO)O)O)O)O)O
;
PRD_900072 InChI            InChI                1.03  
;InChI=1S/C48H82O41/c49-1-9-17(57)18(58)27(67)42(76-9)84-35-11(3-51)78-44(29(69)20(35)60)86-37-13(5-53)80-46(31(71)22(37

)62)88-39-15(7-55)82-48(33(73)24(39)64)89-40-16(8-56)81-47(32(72)25(40)65)87-38-14(6-54)79-45(30(70)23(38)63)85-36-12(4-

52)77-43(28(68)21(36)61)83-34-10(2-50)75-41(74)26(66)19(34)59/h9-74H,1-8H2/t9-,10-,11-,12-,13-,14-,15-,16-,17-,18+,19-,2

0-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42+,43+,44+,45+,46+,47+,48+/m1/s1

;
PRD_900072 InChIKey         InChI                1.03  RUJILUJOOCOSRO-UNLXIWHUSA-N                                                                                                                                                                                                                                                                                                                                                                                                                                                                              
PRD_900072 SMILES_CANONICAL CACTVS               3.385 
;OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@@H]2CO)O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@@H]3CO)O[C@H]4[C@H](O)[C@@

H](O)[C@@H](O[C@@H]4CO)O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@@H]5CO)O[C@H]6[C@H](O)[C@@H](O)[C@@H](O[C@@H]6CO)O[C@H]7[C@H](
 O)[C@@H](O)[C@@H](O[C@@H]7CO)O[C@H]8[C@H](O)[C@@H](O)[C@H](O)O[C@@H]8CO)[C@H](O)[C@@H](O)[C@@H]1O
;
PRD_900072 SMILES           CACTVS               3.385 
;OC[CH]1O[CH](O[CH]2[CH](O)[CH](O)[CH](O[CH]2CO)O[CH]3[CH](O)[CH](O)[CH](O[CH]3CO)O[CH]4[CH](O)[CH](O)[CH](O[CH]4CO)O[CH

]5[CH](O)[CH](O)[CH](O[CH]5CO)O[CH]6[CH](O)[CH](O)[CH](O[CH]6CO)O[CH]7[CH](O)[CH](O)[CH](O[CH]7CO)O[CH]8[CH](O)[CH](O)[C
 H](O)O[CH]8CO)[CH](O)[CH](O)[CH]1O
;
PRD_900072 SMILES_CANONICAL "OpenEye OEToolkits" 2.0.7 
;C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3O)O)O[C@@

H]4[C@H](O[C@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H](O[C@H]([C@@H]([C@H]5O)O)O[C@@H]6[C@H](O[C@H]([C@@H]([C@H]6O)O)O[C@@H]7[C@
 H](O[C@H]([C@@H]([C@H]7O)O)O[C@@H]8[C@H](O[C@H]([C@@H]([C@H]8O)O)O)CO)CO)CO)CO)CO)CO)CO)O)O)O)O
;
PRD_900072 SMILES           "OpenEye OEToolkits" 2.0.7 
;C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)OC5C(OC(C(C5O)O)OC6C(OC(C(C6O)O)OC7C(OC(C(C7O)O)OC8C(OC(
 C(C8O)O)O)CO)CO)CO)CO)CO)CO)CO)O)O)O)O
;
# 
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 
PRD_900072 "SYSTEMATIC NAME" ACDLabs              12.01 
;beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-bet
 a-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranose
;
PRD_900072 "SYSTEMATIC NAME" "OpenEye OEToolkits" 2.0.7 
;(2~{R},3~{S},4~{S},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{R},3~{S},4~{R},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{R},3~{S},

4~{R},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{R},3~{S},4~{R},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{R},3~{S},4~{R},5~{R},6~

{S})-2-(hydroxymethyl)-6-[(2~{R},3~{S},4~{R},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{R},3~{S},4~{R},5~{R},6~{S})-2-(hydrox

ymethyl)-6-[(2~{R},3~{S},4~{R},5~{R},6~{R})-2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-

yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxa
 n-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-oxane-3,4,5-triol
;
# 
