data_50G
# 
_chem_comp.id                                    50G 
_chem_comp.name                                  DENDRON-D1 
_chem_comp.type                                  NON-POLYMER 
_chem_comp.pdbx_type                             HETAIN 
_chem_comp.formula                               "C31 H50 N10 O18" 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         ? 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     2014-08-29 
_chem_comp.pdbx_modified_date                    2014-11-07 
_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                        850.785 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     50G 
_chem_comp.pdbx_model_coordinates_details        ? 
_chem_comp.pdbx_model_coordinates_missing_flag   Y 
_chem_comp.pdbx_ideal_coordinates_details        Corina 
_chem_comp.pdbx_ideal_coordinates_missing_flag   N 
_chem_comp.pdbx_model_coordinates_db_code        4UW3 
_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 
50G O40 O1  O 0 1 N N N -11.827 -7.906  13.846 6.792   -0.964 -1.964 O1  50G 1   
50G C37 C1  C 0 1 N N R -12.274 -8.015  15.269 7.489   -2.069 -1.384 C1  50G 2   
50G C36 C2  C 0 1 N N S -11.226 -8.581  16.087 7.995   -2.994 -2.495 C2  50G 3   
50G O41 O2  O 0 1 N N N -10.059 -7.678  16.140 8.939   -2.294 -3.308 O2  50G 4   
50G C35 C3  C 0 1 N N R -11.688 -8.895  17.473 8.672   -4.213 -1.860 C3  50G 5   
50G O42 O3  O 0 1 N N N -12.061 -7.673  18.148 9.811   -3.789 -1.109 O3  50G 6   
50G C34 C4  C 0 1 N N R -12.893 -9.849  17.435 7.677   -4.912 -0.929 C4  50G 7   
50G C38 C5  C 0 1 N N N -13.452 -10.088 18.727 8.364   -6.095 -0.244 C5  50G 8   
50G O39 O4  O 0 1 N N N -14.497 -11.011 18.572 7.406   -6.817 0.533  O4  50G 9   
50G O33 O5  O 0 1 N N N -13.944 -9.131  16.618 7.222   -3.987 0.061  O5  50G 10  
50G C32 C6  C 0 1 N N R -13.480 -8.856  15.264 6.540   -2.851 -0.472 C6  50G 11  
50G N30 N1  N 0 1 Y N N -14.535 -8.115  14.619 6.096   -1.988 0.626  N1  50G 12  
50G C29 C7  C 0 1 Y N N -15.360 -8.569  13.619 4.811   -1.726 0.959  C7  50G 13  
50G N31 N2  N 0 1 Y N N -14.860 -6.886  14.922 6.862   -1.353 1.443  N2  50G 14  
50G N28 N3  N 0 1 Y N N -15.872 -6.463  14.177 6.155   -0.688 2.287  N3  50G 15  
50G C27 C8  C 0 1 Y N N -16.225 -7.465  13.334 4.860   -0.895 2.026  C8  50G 16  
50G C26 C9  C 0 1 N N N -17.355 -7.411  12.295 3.685   -0.314 2.770  C9  50G 17  
50G O25 O6  O 0 1 N N N -18.455 -8.155  12.812 2.470   -0.774 2.176  O6  50G 18  
50G C22 C10 C 0 1 N N N -19.504 -7.486  13.533 1.289   -0.278 2.810  C10 50G 19  
50G C21 C11 C 0 1 N N N -20.794 -7.639  13.135 0.055   -0.832 2.096  C11 50G 20  
50G C23 C12 C 0 1 N N N -21.017 -8.564  11.958 0.072   -0.390 0.631  C12 50G 21  
50G O43 O7  O 0 1 N N N -20.184 -8.163  10.907 0.059   1.038  0.565  O7  50G 22  
50G N24 N4  N 0 1 N N N -21.768 -7.530  14.173 0.068   -2.300 2.164  N4  50G 23  
50G C20 C13 C 0 1 N N N -21.142 -6.305  12.407 -1.209  -0.302 2.775  C13 50G 24  
50G O19 O8  O 0 1 N N N -22.516 -6.060  12.525 -2.359  -0.910 2.183  O8  50G 25  
50G C18 C14 C 0 1 N N N -22.918 -4.700  12.408 -3.599  -0.480 2.748  C14 50G 26  
50G C17 C15 C 0 1 Y N N -22.109 -4.070  11.274 -4.738  -1.181 2.052  C15 50G 27  
50G C14 C16 C 0 1 Y N N -21.112 -3.057  11.409 -4.640  -2.082 1.046  C16 50G 28  
50G N16 N5  N 0 1 Y N N -22.168 -4.362  9.948  -6.042  -1.039 2.310  N5  50G 29  
50G N15 N6  N 0 1 Y N N -21.287 -3.591  9.299  -6.709  -1.802 1.518  N6  50G 30  
50G N13 N7  N 0 1 Y N N -20.658 -2.814  10.134 -5.908  -2.441 0.738  N7  50G 31  
50G C4  C17 C 0 1 N N R -19.647 -1.900  9.799  -6.301  -3.400 -0.298 C17 50G 32  
50G O5  O9  O 0 1 N N N -20.105 -1.017  8.726  -7.046  -2.725 -1.314 O9  50G 33  
50G C6  C18 C 0 1 N N R -19.038 -0.084  8.310  -7.458  -3.568 -2.391 C18 50G 34  
50G C11 C19 C 0 1 N N N -19.561 0.734   7.178  -8.218  -2.737 -3.427 C19 50G 35  
50G O12 O10 O 0 1 N N N -20.589 1.596   7.624  -7.332  -1.780 -4.013 O10 50G 36  
50G C7  C20 C 0 1 N N R -17.800 -0.857  7.901  -8.372  -4.672 -1.853 C20 50G 37  
50G O8  O11 O 0 1 N N N -18.107 -1.632  6.715  -9.547  -4.087 -1.288 O11 50G 38  
50G C2  C21 C 0 1 N N S -17.366 -1.781  8.977  -7.624  -5.462 -0.774 C21 50G 39  
50G O9  O12 O 0 1 N N N -16.182 -2.542  8.546  -8.494  -6.447 -0.214 O12 50G 40  
50G C3  C22 C 0 1 N N R -18.463 -2.698  9.306  -7.168  -4.497 0.325  C22 50G 41  
50G O10 O13 O 0 1 N N N -18.086 -3.672  10.313 -6.407  -5.211 1.301  O13 50G 42  
50G H1  H1  H 0 1 N N N -11.045 -7.368  13.799 7.333   -0.426 -2.559 H1  50G 43  
50G H2  H2  H 0 1 N N N -12.532 -7.012  15.640 8.334   -1.701 -0.803 H2  50G 44  
50G H3  H3  H 0 1 N N N -10.900 -9.524  15.624 7.156   -3.320 -3.109 H3  50G 45  
50G H4  H4  H 0 1 N N N -9.382  -8.066  16.681 8.579   -1.505 -3.737 H4  50G 46  
50G H5  H5  H 0 1 N N N -10.871 -9.387  18.021 8.987   -4.903 -2.642 H5  50G 47  
50G H6  H6  H 0 1 N N N -12.354 -7.874  19.029 10.482  -3.333 -1.635 H6  50G 48  
50G H7  H7  H 0 1 N N N -12.608 -10.790 16.942 6.827   -5.271 -1.509 H7  50G 49  
50G H8  H8  H 0 1 N N N -12.684 -10.500 19.398 8.789   -6.755 -1.000 H8  50G 50  
50G H9  H9  H 0 1 N N N -13.840 -9.149  19.147 9.158   -5.728 0.406  H9  50G 51  
50G H10 H10 H 0 1 N N N -14.890 -11.190 19.418 7.773   -7.583 0.997  H10 50G 52  
50G H11 H11 H 0 1 N N N -13.284 -9.797  14.728 5.675   -3.182 -1.046 H11 50G 53  
50G H12 H12 H 0 1 N N N -15.357 -9.543  13.152 3.925   -2.105 0.471  H12 50G 54  
50G H13 H13 H 0 1 N N N -17.015 -7.855  11.348 3.723   -0.630 3.812  H13 50G 55  
50G H14 H14 H 0 1 N N N -17.656 -6.367  12.123 3.726   0.775  2.719  H14 50G 56  
50G H15 H15 H 0 1 N N N -19.448 -7.834  14.575 1.277   -0.594 3.854  H15 50G 57  
50G H16 H16 H 0 1 N N N -19.283 -6.409  13.493 1.279   0.811  2.760  H16 50G 58  
50G H17 H17 H 0 1 N N N -22.068 -8.509  11.638 0.973   -0.768 0.148  H17 50G 59  
50G H18 H18 H 0 1 N N N -20.775 -9.597  12.248 -0.807  -0.785 0.122  H18 50G 60  
50G H20 H20 H 0 1 N N N -21.451 -6.877  14.861 0.057   -2.618 3.121  H20 50G 61  
50G H21 H21 H 0 1 N N N -22.634 -7.212  13.786 -0.702  -2.693 1.644  H21 50G 62  
50G H23 H23 H 0 1 N N N -20.873 -6.385  11.343 -1.178  -0.541 3.838  H23 50G 63  
50G H24 H24 H 0 1 N N N -20.580 -5.478  12.866 -1.263  0.780  2.647  H24 50G 64  
50G H25 H25 H 0 1 N N N -22.719 -4.168  13.350 -3.618  -0.723 3.810  H25 50G 65  
50G H26 H26 H 0 1 N N N -23.992 -4.646  12.177 -3.703  0.597  2.619  H26 50G 66  
50G H27 H27 H 0 1 N N N -20.783 -2.581  12.321 -3.734  -2.441 0.583  H27 50G 67  
50G H28 H28 H 0 1 N N N -19.348 -1.306  10.675 -5.409  -3.846 -0.737 H28 50G 68  
50G H29 H29 H 0 1 N N N -18.783 0.579   9.150  -6.582  -4.017 -2.858 H29 50G 69  
50G H30 H30 H 0 1 N N N -19.961 0.065   6.402  -8.609  -3.394 -4.204 H30 50G 70  
50G H31 H31 H 0 1 N N N -18.742 1.335   6.757  -9.044  -2.217 -2.941 H31 50G 71  
50G H32 H32 H 0 1 N N N -20.912 2.110   6.893  -7.748  -1.217 -4.680 H32 50G 72  
50G H33 H33 H 0 1 N N N -16.990 -0.145  7.683  -8.652  -5.342 -2.666 H33 50G 73  
50G H34 H34 H 0 1 N N N -17.338 -2.122  6.448  -10.172 -4.730 -0.927 H34 50G 74  
50G H35 H35 H 0 1 N N N -17.109 -1.192  9.870  -6.755  -5.949 -1.215 H35 50G 75  
50G H36 H36 H 0 1 N N N -15.913 -3.130  9.242  -8.085  -6.985 0.478  H36 50G 76  
50G H37 H37 H 0 1 N N N -18.765 -3.229  8.391  -8.040  -4.047 0.800  H37 50G 77  
50G H38 H38 H 0 1 N N N -18.824 -4.243  10.494 -6.893  -5.926 1.734  H38 50G 78  
50G C1  C23 C 0 1 N N N ?       ?       ?      0.073   1.558  -0.766 C23 50G 79  
50G C5  C24 C 0 1 Y N N ?       ?       ?      0.058   3.064  -0.716 C24 50G 80  
50G C8  C25 C 0 1 Y N N ?       ?       ?      0.035   3.838  0.394  C25 50G 81  
50G N2  N8  N 0 1 Y N N ?       ?       ?      0.029   5.120  -0.040 N8  50G 82  
50G N3  N9  N 0 1 Y N N ?       ?       ?      0.048   5.110  -1.327 N9  50G 83  
50G N1  N10 N 0 1 Y N N ?       ?       ?      0.071   3.899  -1.761 N10 50G 84  
50G C13 C26 C 0 1 N N N ?       ?       ?      0.005   6.313  0.809  C26 50G 85  
50G O1  O14 O 0 1 N N N ?       ?       ?      1.219   7.048  0.634  O14 50G 86  
50G C16 C27 C 0 1 N N N ?       ?       ?      1.457   7.467  -0.711 C27 50G 87  
50G C19 C28 C 0 1 N N N ?       ?       ?      0.326   8.394  -1.163 C28 50G 88  
50G C24 C29 C 0 1 N N N ?       ?       ?      -1.011  7.659  -1.031 C29 50G 89  
50G C9  C30 C 0 1 N N N ?       ?       ?      -1.184  7.194  0.419  C30 50G 90  
50G C10 C31 C 0 1 N N N ?       ?       ?      -2.480  6.391  0.547  C31 50G 91  
50G O3  O15 O 0 1 N N N ?       ?       ?      -2.079  8.541  -1.381 O15 50G 92  
50G O4  O16 O 0 1 N N N ?       ?       ?      0.311   9.564  -0.343 O16 50G 93  
50G O6  O17 O 0 1 N N N ?       ?       ?      2.702   8.165  -0.779 O17 50G 94  
50G O2  O18 O 0 1 N N N ?       ?       ?      -3.596  7.243  0.287  O18 50G 95  
50G H19 H19 H 0 1 N N N ?       ?       ?      0.974   1.220  -1.278 H19 50G 96  
50G H22 H22 H 0 1 N N N ?       ?       ?      -0.806  1.204  -1.304 H22 50G 97  
50G H42 H42 H 0 1 N N N ?       ?       ?      -0.091  6.015  1.853  H42 50G 98  
50G H43 H43 H 0 1 N N N ?       ?       ?      1.494   6.594  -1.363 H43 50G 99  
50G H44 H44 H 0 1 N N N ?       ?       ?      0.483   8.680  -2.204 H44 50G 100 
50G H45 H45 H 0 1 N N N ?       ?       ?      -1.018  6.793  -1.694 H45 50G 101 
50G H46 H46 H 0 1 N N N ?       ?       ?      -1.226  8.062  1.077  H46 50G 102 
50G H47 H47 H 0 1 N N N ?       ?       ?      -2.472  5.572  -0.173 H47 50G 103 
50G H48 H48 H 0 1 N N N ?       ?       ?      -2.558  5.986  1.556  H48 50G 104 
50G H49 H49 H 0 1 N N N ?       ?       ?      -2.029  8.880  -2.285 H49 50G 105 
50G H50 H50 H 0 1 N N N ?       ?       ?      1.130   10.077 -0.374 H50 50G 106 
50G H51 H51 H 0 1 N N N ?       ?       ?      3.465   7.637  -0.506 H51 50G 107 
50G H52 H52 H 0 1 N N N ?       ?       ?      -4.453  6.799  0.351  H52 50G 108 
50G H40 H40 H 0 1 N N N ?       ?       ?      0.023   3.500  1.420  H40 50G 109 
# 
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 
50G O8  C7  SING N N 1   
50G C11 O12 SING N N 2   
50G C11 C6  SING N N 3   
50G C7  C6  SING N N 4   
50G C7  C2  SING N N 5   
50G C6  O5  SING N N 6   
50G O9  C2  SING N N 7   
50G O5  C4  SING N N 8   
50G C2  C3  SING N N 9   
50G N15 N16 DOUB Y N 10  
50G N15 N13 SING Y N 11  
50G C3  C4  SING N N 12  
50G C3  O10 SING N N 13  
50G C4  N13 SING N N 14  
50G N16 C17 SING Y N 15  
50G N13 C14 SING Y N 16  
50G O43 C23 SING N N 17  
50G C17 C14 DOUB Y N 18  
50G C17 C18 SING N N 19  
50G C23 C21 SING N N 20  
50G C26 O25 SING N N 21  
50G C26 C27 SING N N 22  
50G C20 O19 SING N N 23  
50G C20 C21 SING N N 24  
50G C18 O19 SING N N 25  
50G O25 C22 SING N N 26  
50G C21 C22 SING N N 27  
50G C21 N24 SING N N 28  
50G C27 C29 DOUB Y N 29  
50G C27 N28 SING Y N 30  
50G C29 N30 SING Y N 31  
50G O40 C37 SING N N 32  
50G N28 N31 DOUB Y N 33  
50G N30 N31 SING Y N 34  
50G N30 C32 SING N N 35  
50G C32 C37 SING N N 36  
50G C32 O33 SING N N 37  
50G C37 C36 SING N N 38  
50G C36 O41 SING N N 39  
50G C36 C35 SING N N 40  
50G O33 C34 SING N N 41  
50G C34 C35 SING N N 42  
50G C34 C38 SING N N 43  
50G C35 O42 SING N N 44  
50G O39 C38 SING N N 45  
50G O40 H1  SING N N 46  
50G C37 H2  SING N N 47  
50G C36 H3  SING N N 48  
50G O41 H4  SING N N 49  
50G C35 H5  SING N N 50  
50G O42 H6  SING N N 51  
50G C34 H7  SING N N 52  
50G C38 H8  SING N N 53  
50G C38 H9  SING N N 54  
50G O39 H10 SING N N 55  
50G C32 H11 SING N N 56  
50G C29 H12 SING N N 57  
50G C26 H13 SING N N 58  
50G C26 H14 SING N N 59  
50G C22 H15 SING N N 60  
50G C22 H16 SING N N 61  
50G C23 H17 SING N N 62  
50G C23 H18 SING N N 63  
50G N24 H20 SING N N 64  
50G N24 H21 SING N N 65  
50G C20 H23 SING N N 66  
50G C20 H24 SING N N 67  
50G C18 H25 SING N N 68  
50G C18 H26 SING N N 69  
50G C14 H27 SING N N 70  
50G C4  H28 SING N N 71  
50G C6  H29 SING N N 72  
50G C11 H30 SING N N 73  
50G C11 H31 SING N N 74  
50G O12 H32 SING N N 75  
50G C7  H33 SING N N 76  
50G O8  H34 SING N N 77  
50G C2  H35 SING N N 78  
50G O9  H36 SING N N 79  
50G C3  H37 SING N N 80  
50G O10 H38 SING N N 81  
50G O43 C1  SING N N 82  
50G C1  C5  SING N N 83  
50G C5  C8  DOUB Y N 84  
50G C8  N2  SING Y N 85  
50G N2  N3  SING Y N 86  
50G N3  N1  DOUB Y N 87  
50G N1  C5  SING Y N 88  
50G N2  C13 SING N N 89  
50G C13 O1  SING N N 90  
50G O1  C16 SING N N 91  
50G C16 C19 SING N N 92  
50G C19 C24 SING N N 93  
50G C24 C9  SING N N 94  
50G C9  C13 SING N N 95  
50G C9  C10 SING N N 96  
50G C24 O3  SING N N 97  
50G C19 O4  SING N N 98  
50G C16 O6  SING N N 99  
50G C10 O2  SING N N 100 
50G C1  H19 SING N N 101 
50G C1  H22 SING N N 102 
50G C8  H40 SING N N 103 
50G C13 H42 SING N N 104 
50G C16 H43 SING N N 105 
50G C19 H44 SING N N 106 
50G C24 H45 SING N N 107 
50G C9  H46 SING N N 108 
50G C10 H47 SING N N 109 
50G C10 H48 SING N N 110 
50G O3  H49 SING N N 111 
50G O4  H50 SING N N 112 
50G O6  H51 SING N N 113 
50G O2  H52 SING N N 114 
# 
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 
50G SMILES           ACDLabs              12.01 "OC1C(C(OC(O)C1O)n2nnc(c2)COCC(N)(COCc3nnn(c3)C4OC(CO)C(O)C(O)C4O)COCc5nnn(c5)C6OC(CO)C(O)C(O)C6O)CO" 
50G InChI            InChI                1.03  
;InChI=1S/C31H50N10O18/c32-31(10-54-7-13-1-39(36-33-13)27-16(4-42)19(45)26(52)30(53)59-27,11-55-8-14-2-40(37-34-14)28-24(50)22(48)20(46)17(5-43)57-28)12-56-9-15-3-41(38-35-15)29-25(51)23(49)21(47)18(6-44)58-29/h1-3,16-30,42-53H,4-12,32H2/t16?,17-,18-,19?,20+,21+,22+,23+,24-,25-,26?,27?,28-,29-,30?/m1/s1
;
50G InChIKey         InChI                1.03  VLZLQHDSQRKRHA-NBVMFUKPSA-N 
50G SMILES_CANONICAL CACTVS               3.385 "N[C@](COCc1cn(nn1)[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)(COCc3cn(nn3)[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)COCc5cn(nn5)C6OC(O)C(O)C(O)C6CO" 
50G SMILES           CACTVS               3.385 "N[C](COCc1cn(nn1)[CH]2O[CH](CO)[CH](O)[CH](O)[CH]2O)(COCc3cn(nn3)[CH]4O[CH](CO)[CH](O)[CH](O)[CH]4O)COCc5cn(nn5)C6OC(O)C(O)C(O)C6CO" 
50G SMILES_CANONICAL "OpenEye OEToolkits" 1.7.6 "c1c(nnn1[C@H]2[C@@H]([C@@H]([C@@H]([C@@H](O2)O)O)O)CO)COCC(COCc3cn(nn3)[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)(COCc5cn(nn5)[C@H]6[C@@H]([C@H]([C@H]([C@H](O6)CO)O)O)O)N" 
50G SMILES           "OpenEye OEToolkits" 1.7.6 "c1c(nnn1C2C(C(C(C(O2)O)O)O)CO)COCC(COCc3cn(nn3)C4C(C(C(C(O4)CO)O)O)O)(COCc5cn(nn5)C6C(C(C(C(O6)CO)O)O)O)N" 
# 
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 
50G "SYSTEMATIC NAME" ACDLabs              12.01 
;6-[4-({2-amino-3-({1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]-1H-1,2,3-triazol-4-yl}methoxy)-2-[({1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]-1H-1,2,3-triazol-4-yl}methoxy)methyl]propoxy}methyl)-1H-1,2,3-triazol-1-yl]-5-(hydroxymethyl)tetrahydro-2H-pyran-2,3,4-triol (non-preferred name)
;
50G "SYSTEMATIC NAME" "OpenEye OEToolkits" 1.7.6 
;(2R,3S,4S,5R,6R)-6-[4-[[2-azanyl-3-[[1-[(2R,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-1,2,3-triazol-4-yl]methoxy]-2-[[1-[(2R,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-1,2,3-triazol-4-yl]methoxymethyl]propoxy]methyl]-1,2,3-triazol-1-yl]-5-(hydroxymethyl)oxane-2,3,4-triol
;
# 
loop_
_pdbx_chem_comp_audit.comp_id 
_pdbx_chem_comp_audit.action_type 
_pdbx_chem_comp_audit.date 
_pdbx_chem_comp_audit.processing_site 
50G "Create component"   2014-08-29 EBI  
50G "Other modification" 2014-08-29 EBI  
50G "Initial release"    2014-11-12 RCSB 
# 
