data_C8P
#

_chem_comp.id                                   C8P
_chem_comp.name                                 "N-{(1S,2S,3R)-1-[(alpha-D-galactopyranosyloxy)methyl]-2,3-dihydroxyheptadecyl}-8-phenyloctanamide"
_chem_comp.type                                 NON-POLYMER
_chem_comp.pdbx_type                            HETAIN
_chem_comp.formula                              "C38 H67 N O9"
_chem_comp.mon_nstd_parent_comp_id              ?
_chem_comp.pdbx_synonyms                        "(2S,3S,4R)-N-PHENYLOCTANOYL-1-[(ALPHA-D-GALACTOPYRANOSYL)OXY]-2-AMINO-OCTADECANE-3,4-DIOL"
_chem_comp.pdbx_formal_charge                   0
_chem_comp.pdbx_initial_date                    2009-04-07
_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                       681.940
_chem_comp.one_letter_code                      ?
_chem_comp.three_letter_code                    C8P
_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       3GMM
_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
C8P  O25   O25   O  0  1  N  N  N   1.132   -7.137  18.090    2.875   0.469   2.109  O25   C8P    1  
C8P  C25   C25   C  0  1  N  N  N   2.145   -7.725  18.503    2.472   0.508   0.965  C25   C8P    2  
C8P  C26   C26   C  0  1  N  N  N   2.149   -9.175  19.015    3.082  -0.389  -0.080  C26   C8P    3  
C8P  C27   C27   C  0  1  N  N  N   1.052   -9.960  18.353    4.180  -1.243   0.559  C27   C8P    4  
C8P  C28   C28   C  0  1  N  N  N   1.592  -10.219  16.930    4.800  -2.154  -0.503  C28   C8P    5  
C8P  C29   C29   C  0  1  N  N  N   0.595  -11.194  16.172    5.897  -3.007   0.136  C29   C8P    6  
C8P  C30   C30   C  0  1  N  N  N   1.067  -11.492  14.702    6.517  -3.919  -0.925  C30   C8P    7  
C8P  C31   C31   C  0  1  N  N  N  -0.153  -12.085  13.917    7.614  -4.772  -0.287  C31   C8P    8  
C8P  C32   C32   C  0  1  N  N  N   0.207  -12.350  12.436    8.234  -5.683  -1.348  C32   C8P    9  
C8P  CI    CI    C  0  1  Y  N  N  -0.967  -12.695  11.508    9.315  -6.524  -0.719  CI    C8P   10  
C8P  CJ2   CJ2   C  0  1  Y  N  N  -2.115  -11.929  11.472    9.004  -7.756  -0.175  CJ2   C8P   11  
C8P  CK2   CK2   C  0  1  Y  N  N  -3.165  -12.258  10.616    9.995  -8.528   0.402  CK2   C8P   12  
C8P  CL    CL    C  0  1  Y  N  N  -3.063  -13.385   9.792   11.298  -8.067   0.434  CL    C8P   13  
C8P  CK1   CK1   C  0  1  Y  N  N  -1.919  -14.176   9.834   11.610  -6.835  -0.110  CK1   C8P   14  
C8P  CJ1   CJ1   C  0  1  Y  N  N  -0.873  -13.800  10.681   10.619  -6.066  -0.691  CJ1   C8P   15  
C8P  N     N     N  0  1  N  N  N   3.320   -7.087  18.552    1.474   1.351   0.631  N     C8P   16  
C8P  C17   C17   C  0  1  N  N  S   3.421   -5.692  18.137    0.877   2.219   1.649  C17   C8P   17  
C8P  C18   C18   C  0  1  N  N  N   3.341   -4.864  19.459    1.711   3.494   1.785  C18   C8P   18  
C8P  O18   O18   O  0  1  N  N  N   4.443   -5.167  20.349    1.655   4.233   0.562  O18   C8P   19  
C8P  C19   C19   C  0  1  N  N  S   4.493   -4.501  21.639    2.405   5.449   0.583  C19   C8P   20  
C8P  C20   C20   C  0  1  N  N  R   5.682   -5.014  22.401    2.078   6.271  -0.666  C20   C8P   21  
C8P  O20   O20   O  0  1  N  N  N   6.832   -4.774  21.612    0.673   6.525  -0.717  O20   C8P   22  
C8P  C21   C21   C  0  1  N  N  S   5.669   -6.518  22.569    2.501   5.485  -1.911  C21   C8P   23  
C8P  O21   O21   O  0  1  N  N  N   6.790   -6.896  23.368    2.268   6.276  -3.078  O21   C8P   24  
C8P  C22   C22   C  0  1  N  N  R   4.418   -6.922  23.335    3.993   5.152  -1.808  C22   C8P   25  
C8P  O22   O22   O  0  1  N  N  N   4.638   -6.445  24.669    4.753   6.362  -1.793  O22   C8P   26  
C8P  C23   C23   C  0  1  N  N  R   3.203   -6.273  22.681    4.246   4.372  -0.515  C23   C8P   27  
C8P  C24   C24   C  0  1  N  N  N   1.977   -6.402  23.572    5.742   4.088  -0.375  C24   C8P   28  
C8P  O24   O24   O  0  1  N  N  N   1.204   -7.449  22.970    5.965   3.262   0.770  O24   C8P   29  
C8P  O19   O19   O  0  1  N  N  N   3.349   -4.887  22.380    3.802   5.147   0.601  O19   C8P   30  
C8P  C16   C16   C  0  1  N  N  S   4.766   -5.526  17.473   -0.550   2.584   1.233  C16   C8P   31  
C8P  O16   O16   O  0  1  N  N  N   4.778   -4.152  17.128   -1.087   3.532   2.158  O16   C8P   32  
C8P  C15   C15   C  0  1  N  N  R   5.049   -6.377  16.211   -1.419   1.325   1.231  C15   C8P   33  
C8P  O15   O15   O  0  1  N  N  N   6.290   -5.944  15.588   -0.881   0.377   0.306  O15   C8P   34  
C8P  C14   C14   C  0  1  N  N  N   3.981   -6.201  15.123   -2.845   1.690   0.815  C14   C8P   35  
C8P  C13   C13   C  0  1  N  N  N   4.245   -6.951  13.799   -3.742   0.456   0.932  C13   C8P   36  
C8P  C12   C12   C  0  1  N  N  N   4.398   -8.440  13.992   -5.169   0.821   0.517  C12   C8P   37  
C8P  C11   C11   C  0  1  N  N  N   4.514   -9.292  12.716   -6.066  -0.413   0.634  C11   C8P   38  
C8P  C10   C10   C  0  1  N  N  N   5.719   -8.934  11.828   -7.492  -0.047   0.219  C10   C8P   39  
C8P  C9    C9    C  0  1  N  N  N   5.774   -9.984  10.713   -8.389  -1.281   0.336  C9    C8P   40  
C8P  C8    C8    C  0  1  N  N  N   6.633   -9.274   9.664   -9.816  -0.916  -0.079  C8    C8P   41  
C8P  C7    C7    C  0  1  N  N  N   7.200  -10.203   8.635  -10.713  -2.150   0.038  C7    C8P   42  
C8P  C6    C6    C  0  1  N  N  N   8.195   -9.384   7.805  -12.139  -1.785  -0.377  C6    C8P   43  
C8P  C5    C5    C  0  1  N  N  N   7.590   -8.948   6.481  -13.036  -3.019  -0.260  C5    C8P   44  
C8P  C4    C4    C  0  1  N  N  N   8.517   -8.721   5.260  -14.463  -2.653  -0.675  C4    C8P   45  
C8P  C3    C3    C  0  1  N  N  N   8.819   -7.198   5.149  -15.360  -3.887  -0.558  C3    C8P   46  
C8P  C2    C2    C  0  1  N  N  N   8.952   -6.811   3.705  -16.787  -3.522  -0.974  C2    C8P   47  
C8P  C1    C1    C  0  1  N  N  N   9.051   -5.299   3.612  -17.684  -4.756  -0.857  C1    C8P   48  
C8P  H26   H26   H  0  1  N  N  N   3.119   -9.639  18.782    2.312  -1.039  -0.496  H26   C8P   49  
C8P  H26A  H26A  H  0  0  N  N  N   1.985   -9.173  20.103    3.512   0.220  -0.875  H26A  C8P   50  
C8P  H27   H27   H  0  1  N  N  N   0.855  -10.902  18.885    4.950  -0.593   0.974  H27   C8P   51  
C8P  H27A  H27A  H  0  0  N  N  N   0.091   -9.425  18.350    3.750  -1.852   1.354  H27A  C8P   52  
C8P  H28   H28   H  0  1  N  N  N   1.666   -9.267  16.383    4.030  -2.804  -0.919  H28   C8P   53  
C8P  H28A  H28A  H  0  0  N  N  N   2.590  -10.678  16.988    5.230  -1.545  -1.298  H28A  C8P   54  
C8P  H29   H29   H  0  1  N  N  N   0.544  -12.144  16.724    6.667  -2.358   0.552  H29   C8P   55  
C8P  H29A  H29A  H  0  0  N  N  N  -0.389  -10.705  16.122    5.467  -3.616   0.931  H29A  C8P   56  
C8P  H30   H30   H  0  1  N  N  N   1.409  -10.564  14.221    5.747  -4.568  -1.341  H30   C8P   57  
C8P  H30A  H30A  H  0  0  N  N  N   1.904  -12.206  14.706    6.947  -3.310  -1.721  H30A  C8P   58  
C8P  H31   H31   H  0  1  N  N  N  -0.450  -13.034  14.386    8.384  -4.122   0.129  H31   C8P   59  
C8P  H31A  H31A  H  0  0  N  N  N  -0.976  -11.356  13.950    7.185  -5.381   0.508  H31A  C8P   60  
C8P  H32   H32   H  0  1  N  N  N   0.677  -11.436  12.044    7.464  -6.333  -1.764  H32   C8P   61  
C8P  H32A  H32A  H  0  0  N  N  N   0.857  -13.237  12.440    8.664  -5.075  -2.144  H32A  C8P   62  
C8P  HJ2   HJ2   H  0  1  N  N  N  -2.201  -11.065  12.114    7.986  -8.116  -0.201  HJ2   C8P   63  
C8P  HK2   HK2   H  0  1  N  N  N  -4.054  -11.645  10.589    9.752  -9.490   0.827  HK2   C8P   64  
C8P  HL    HL    H  0  1  N  N  N  -3.872  -13.641   9.124   12.073  -8.669   0.886  HL    C8P   65  
C8P  HK1   HK1   H  0  1  N  N  N  -1.841  -15.064   9.224   12.628  -6.475  -0.084  HK1   C8P   66  
C8P  HJ1   HJ1   H  0  1  N  N  N   0.033  -14.388  10.690   10.863  -5.105  -1.120  HJ1   C8P   67  
C8P  HN    HN    H  0  1  N  N  N   4.134   -7.569  18.875    1.152   1.382  -0.283  HN    C8P   68  
C8P  H17   H17   H  0  1  N  N  N   2.638   -5.371  17.435    0.854   1.696   2.605  H17   C8P   69  
C8P  H18   H18   H  0  1  N  N  N   3.374   -3.794  19.208    1.312   4.104   2.596  H18   C8P   70  
C8P  H18A  H18A  H  0  0  N  N  N   2.403   -5.124  19.972    2.745   3.230   2.003  H18A  C8P   71  
C8P  H19   H19   H  0  1  N  N  N   4.544   -3.412  21.495    2.145   6.021   1.473  H19   C8P   72  
C8P  H20   H20   H  0  1  N  N  N   5.669   -4.517  23.382    2.618   7.218  -0.631  H20   C8P   73  
C8P  HO20  HO20  H  0  0  N  N  N   6.583   -4.720  20.697    0.334   7.016   0.045  HO20  C8P   74  
C8P  H21   H21   H  0  1  N  N  N   5.698   -6.999  21.580    1.924   4.563  -1.974  H21   C8P   75  
C8P  HO21  HO21  H  0  0  N  N  N   7.559   -6.980  22.816    1.343   6.530  -3.202  HO21  C8P   76  
C8P  H22   H22   H  0  1  N  N  N   4.229   -8.006  23.337    4.291   4.546  -2.664  H22   C8P   77  
C8P  HO22  HO22  H  0  0  N  N  N   4.687   -7.183  25.266    4.637   6.909  -2.581  HO22  C8P   78  
C8P  H23   H23   H  0  1  N  N  N   3.093   -6.818  21.732    3.698   3.431  -0.545  H23   C8P   79  
C8P  H24   H24   H  0  1  N  N  N   2.261   -6.660  24.603    6.100   3.575  -1.268  H24   C8P   80  
C8P  H24A  H24A  H  0  0  N  N  N   1.415   -5.459  23.645    6.281   5.028  -0.255  H24A  C8P   81  
C8P  HO24  HO24  H  0  0  N  N  N   1.033   -7.234  22.061    6.894   3.040   0.920  HO24  C8P   82  
C8P  H16   H16   H  0  1  N  N  N   5.548   -5.873  18.164   -0.537   3.019   0.234  H16   C8P   83  
C8P  HO16  HO16  H  0  0  N  N  N   4.781   -3.626  17.919   -1.059   3.241   3.080  HO16  C8P   84  
C8P  H15   H15   H  0  1  N  N  N   5.077   -7.420  16.560   -1.431   0.890   2.230  H15   C8P   85  
C8P  HO15  HO15  H  0  0  N  N  N   6.159   -5.850  14.652   -0.840   0.698  -0.606  HO15  C8P   86  
C8P  H14   H14   H  0  1  N  N  N   3.030   -6.575  15.530   -3.223   2.477   1.468  H14   C8P   87  
C8P  H14A  H14A  H  0  0  N  N  N   3.978   -5.130  14.870   -2.844   2.042  -0.216  H14A  C8P   88  
C8P  H13   H13   H  0  1  N  N  N   3.394   -6.774  13.124   -3.364  -0.331   0.280  H13   C8P   89  
C8P  H13A  H13A  H  0  0  N  N  N   5.189   -6.570  13.382   -3.743   0.104   1.964  H13A  C8P   90  
C8P  H12   H12   H  0  1  N  N  N   5.318   -8.599  14.573   -5.547   1.609   1.169  H12   C8P   91  
C8P  H12A  H12A  H  0  0  N  N  N   3.470   -8.770  14.483   -5.168   1.173  -0.514  H12A  C8P   92  
C8P  H11   H11   H  0  1  N  N  N   4.617  -10.344  13.019   -5.688  -1.200  -0.018  H11   C8P   93  
C8P  H11A  H11A  H  0  0  N  N  N   3.610   -9.100  12.120   -6.067  -0.765   1.666  H11A  C8P   94  
C8P  H10   H10   H  0  1  N  N  N   5.595   -7.928  11.401   -7.870   0.740   0.871  H10   C8P   95  
C8P  H10A  H10A  H  0  0  N  N  N   6.651   -8.931  12.412   -7.492   0.305  -0.812  H10A  C8P   96  
C8P  H9    H9    H  0  1  N  N  N   6.228  -10.927  11.052   -8.011  -2.068  -0.316  H9    C8P   97  
C8P  H9A   H9A   H  0  1  N  N  N   4.785  -10.292  10.343   -8.390  -1.633   1.368  H9A   C8P   98  
C8P  H8    H8    H  0  1  N  N  N   6.004   -8.533   9.149  -10.194  -0.129   0.573  H8    C8P   99  
C8P  H8A   H8A   H  0  1  N  N  N   7.481   -8.813  10.192   -9.815  -0.564  -1.111  H8A   C8P  100  
C8P  H7    H7    H  0  1  N  N  N   7.709  -11.049   9.120  -10.335  -2.937  -0.614  H7    C8P  101  
C8P  H7A   H7A   H  0  1  N  N  N   6.405  -10.621   7.999  -10.714  -2.502   1.069  H7A   C8P  102  
C8P  H6    H6    H  0  1  N  N  N   8.480   -8.488   8.376  -12.517  -0.997   0.275  H6    C8P  103  
C8P  H6A   H6A   H  0  1  N  N  N   9.071  -10.015   7.594  -12.139  -1.433  -1.409  H6A   C8P  104  
C8P  H5    H5    H  0  1  N  N  N   6.883   -9.739   6.189  -12.658  -3.806  -0.913  H5    C8P  105  
C8P  H5A   H5A   H  0  1  N  N  N   7.179   -7.950   6.692  -13.037  -3.371   0.771  H5A   C8P  106  
C8P  H4    H4    H  0  1  N  N  N   9.455   -9.279   5.395  -14.841  -1.866  -0.023  H4    C8P  107  
C8P  H4A   H4A   H  0  1  N  N  N   8.026   -9.076   4.342  -14.462  -2.301  -1.707  H4A   C8P  108  
C8P  H3    H3    H  0  1  N  N  N   7.996   -6.629   5.605  -14.982  -4.674  -1.211  H3    C8P  109  
C8P  H3A   H3A   H  0  1  N  N  N   9.760   -6.974   5.674  -15.361  -4.239   0.473  H3A   C8P  110  
C8P  H2    H2    H  0  1  N  N  N   9.857   -7.269   3.280  -17.165  -2.735  -0.321  H2    C8P  111  
C8P  H2A   H2A   H  0  1  N  N  N   8.076   -7.164   3.141  -16.786  -3.170  -2.005  H2A   C8P  112  
C8P  H1    H1    H  0  1  N  N  N   9.075   -4.870   4.624  -18.700  -4.496  -1.152  H1    C8P  113  
C8P  H1A   H1A   H  0  1  N  N  N   9.971   -5.024   3.076  -17.306  -5.543  -1.509  H1A   C8P  114  
C8P  H1B   H1B   H  0  1  N  N  N   8.178   -4.907   3.069  -17.684  -5.108   0.175  H1B   C8P  115  
#   #
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
C8P  O25  C25   DOUB  N  N    1  
C8P  C25  C26   SING  N  N    2  
C8P  C25  N     SING  N  N    3  
C8P  C26  C27   SING  N  N    4  
C8P  C27  C28   SING  N  N    5  
C8P  C28  C29   SING  N  N    6  
C8P  C29  C30   SING  N  N    7  
C8P  C30  C31   SING  N  N    8  
C8P  C31  C32   SING  N  N    9  
C8P  C32  CI    SING  N  N   10  
C8P  CI   CJ2   DOUB  Y  N   11  
C8P  CI   CJ1   SING  Y  N   12  
C8P  CJ2  CK2   SING  Y  N   13  
C8P  CK2  CL    DOUB  Y  N   14  
C8P  CL   CK1   SING  Y  N   15  
C8P  CK1  CJ1   DOUB  Y  N   16  
C8P  N    C17   SING  N  N   17  
C8P  C17  C18   SING  N  N   18  
C8P  C17  C16   SING  N  N   19  
C8P  C18  O18   SING  N  N   20  
C8P  O18  C19   SING  N  N   21  
C8P  C19  C20   SING  N  N   22  
C8P  C19  O19   SING  N  N   23  
C8P  C20  O20   SING  N  N   24  
C8P  C20  C21   SING  N  N   25  
C8P  C21  O21   SING  N  N   26  
C8P  C21  C22   SING  N  N   27  
C8P  C22  O22   SING  N  N   28  
C8P  C22  C23   SING  N  N   29  
C8P  C23  C24   SING  N  N   30  
C8P  C23  O19   SING  N  N   31  
C8P  C24  O24   SING  N  N   32  
C8P  C16  O16   SING  N  N   33  
C8P  C16  C15   SING  N  N   34  
C8P  C15  O15   SING  N  N   35  
C8P  C15  C14   SING  N  N   36  
C8P  C14  C13   SING  N  N   37  
C8P  C13  C12   SING  N  N   38  
C8P  C12  C11   SING  N  N   39  
C8P  C11  C10   SING  N  N   40  
C8P  C10  C9    SING  N  N   41  
C8P  C9   C8    SING  N  N   42  
C8P  C8   C7    SING  N  N   43  
C8P  C7   C6    SING  N  N   44  
C8P  C6   C5    SING  N  N   45  
C8P  C5   C4    SING  N  N   46  
C8P  C4   C3    SING  N  N   47  
C8P  C3   C2    SING  N  N   48  
C8P  C2   C1    SING  N  N   49  
C8P  C26  H26   SING  N  N   50  
C8P  C26  H26A  SING  N  N   51  
C8P  C27  H27   SING  N  N   52  
C8P  C27  H27A  SING  N  N   53  
C8P  C28  H28   SING  N  N   54  
C8P  C28  H28A  SING  N  N   55  
C8P  C29  H29   SING  N  N   56  
C8P  C29  H29A  SING  N  N   57  
C8P  C30  H30   SING  N  N   58  
C8P  C30  H30A  SING  N  N   59  
C8P  C31  H31   SING  N  N   60  
C8P  C31  H31A  SING  N  N   61  
C8P  C32  H32   SING  N  N   62  
C8P  C32  H32A  SING  N  N   63  
C8P  CJ2  HJ2   SING  N  N   64  
C8P  CK2  HK2   SING  N  N   65  
C8P  CL   HL    SING  N  N   66  
C8P  CK1  HK1   SING  N  N   67  
C8P  CJ1  HJ1   SING  N  N   68  
C8P  N    HN    SING  N  N   69  
C8P  C17  H17   SING  N  N   70  
C8P  C18  H18   SING  N  N   71  
C8P  C18  H18A  SING  N  N   72  
C8P  C19  H19   SING  N  N   73  
C8P  C20  H20   SING  N  N   74  
C8P  O20  HO20  SING  N  N   75  
C8P  C21  H21   SING  N  N   76  
C8P  O21  HO21  SING  N  N   77  
C8P  C22  H22   SING  N  N   78  
C8P  O22  HO22  SING  N  N   79  
C8P  C23  H23   SING  N  N   80  
C8P  C24  H24   SING  N  N   81  
C8P  C24  H24A  SING  N  N   82  
C8P  O24  HO24  SING  N  N   83  
C8P  C16  H16   SING  N  N   84  
C8P  O16  HO16  SING  N  N   85  
C8P  C15  H15   SING  N  N   86  
C8P  O15  HO15  SING  N  N   87  
C8P  C14  H14   SING  N  N   88  
C8P  C14  H14A  SING  N  N   89  
C8P  C13  H13   SING  N  N   90  
C8P  C13  H13A  SING  N  N   91  
C8P  C12  H12   SING  N  N   92  
C8P  C12  H12A  SING  N  N   93  
C8P  C11  H11   SING  N  N   94  
C8P  C11  H11A  SING  N  N   95  
C8P  C10  H10   SING  N  N   96  
C8P  C10  H10A  SING  N  N   97  
C8P  C9   H9    SING  N  N   98  
C8P  C9   H9A   SING  N  N   99  
C8P  C8   H8    SING  N  N  100  
C8P  C8   H8A   SING  N  N  101  
C8P  C7   H7    SING  N  N  102  
C8P  C7   H7A   SING  N  N  103  
C8P  C6   H6    SING  N  N  104  
C8P  C6   H6A   SING  N  N  105  
C8P  C5   H5    SING  N  N  106  
C8P  C5   H5A   SING  N  N  107  
C8P  C4   H4    SING  N  N  108  
C8P  C4   H4A   SING  N  N  109  
C8P  C3   H3    SING  N  N  110  
C8P  C3   H3A   SING  N  N  111  
C8P  C2   H2    SING  N  N  112  
C8P  C2   H2A   SING  N  N  113  
C8P  C1   H1    SING  N  N  114  
C8P  C1   H1A   SING  N  N  115  
C8P  C1   H1B   SING  N  N  116  
#   #
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
C8P  SMILES            ACDLabs               10.04  "O=C(NC(COC1OC(C(O)C(O)C1O)CO)C(O)C(O)CCCCCCCCCCCCCC)CCCCCCCc2ccccc2"  
C8P  SMILES_CANONICAL  CACTVS                3.341  "CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@H](CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCc2ccccc2"  
C8P  SMILES            CACTVS                3.341  "CCCCCCCCCCCCCC[CH](O)[CH](O)[CH](CO[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1O)NC(=O)CCCCCCCc2ccccc2"  
C8P  SMILES_CANONICAL  "OpenEye OEToolkits"  1.5.0  "CCCCCCCCCCCCCC[C@H]([C@H]([C@H](CO[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)NC(=O)CCCCCCCc2ccccc2)O)O"  
C8P  SMILES            "OpenEye OEToolkits"  1.5.0  "CCCCCCCCCCCCCCC(C(C(COC1C(C(C(C(O1)CO)O)O)O)NC(=O)CCCCCCCc2ccccc2)O)O"  
C8P  InChI             InChI                 1.03   "InChI=1S/C38H67NO9/c1-2-3-4-5-6-7-8-9-10-11-14-20-25-31(41)34(43)30(28-47-38-37(46)36(45)35(44)32(27-40)48-38)39-33(42)26-21-15-12-13-17-22-29-23-18-16-19-24-29/h16,18-19,23-24,30-32,34-38,40-41,43-46H,2-15,17,20-22,25-28H2,1H3,(H,39,42)/t30-,31+,32+,34-,35-,36-,37+,38-/m0/s1"  
C8P  InChIKey          InChI                 1.03   YEKLGTQAMSELFI-ZORUMLJWSA-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
C8P  "SYSTEMATIC NAME"  ACDLabs               10.04  "N-{(1S,2S,3R)-1-[(alpha-D-galactopyranosyloxy)methyl]-2,3-dihydroxyheptadecyl}-8-phenyloctanamide"  
C8P  "SYSTEMATIC NAME"  "OpenEye OEToolkits"  1.5.0  "N-[(2S,3S,4R)-3,4-dihydroxy-1-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-octadecan-2-yl]-8-phenyl-octanamide"  
#   #
loop_
_pdbx_chem_comp_audit.comp_id
_pdbx_chem_comp_audit.action_type
_pdbx_chem_comp_audit.date
_pdbx_chem_comp_audit.processing_site
C8P  "Create component"      2009-04-07  RCSB  
C8P  "Modify aromatic_flag"  2011-06-04  RCSB  
C8P  "Modify descriptor"     2011-06-04  RCSB  
C8P  "Modify synonyms"       2020-06-05  PDBE  
#
_pdbx_chem_comp_synonyms.ordinal     1
_pdbx_chem_comp_synonyms.comp_id     C8P
_pdbx_chem_comp_synonyms.name        "(2S,3S,4R)-N-PHENYLOCTANOYL-1-[(ALPHA-D-GALACTOPYRANOSYL)OXY]-2-AMINO-OCTADECANE-3,4-DIOL"
_pdbx_chem_comp_synonyms.provenance  ?
_pdbx_chem_comp_synonyms.type        ?
##
