data_VA0
# 
_chem_comp.id                                    VA0 
_chem_comp.name                                  "Rifamycin S" 
_chem_comp.type                                  non-polymer 
_chem_comp.pdbx_type                             HETAIN 
_chem_comp.formula                               "C37 H45 N O12" 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         "(2S,12Z,14Z,16S,17S,18R,19R,20R,21S,22R,23S,24E)-5,17,19-trihydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,6,9,11-tetraoxo-1,2,6,9-tetrahydro-2,7-(epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan-21-yl acetate" 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     2022-08-18 
_chem_comp.pdbx_modified_date                    2023-03-10 
_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                        695.753 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     VA0 
_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        8E3N 
_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 
VA0 C1  C1  C 0 1 N N N 14.980 -14.664 -0.316 14.980 -14.664 -0.316 C1  VA0 1  
VA0 C2  C2  C 0 1 N N N 14.986 -15.194 -1.719 14.986 -15.194 -1.719 C2  VA0 2  
VA0 C3  C3  C 0 1 N N N 14.438 -14.468 -2.718 14.438 -14.468 -2.718 C3  VA0 3  
VA0 C4  C4  C 0 1 N N N 13.680 -13.259 -2.436 13.680 -13.259 -2.436 C4  VA0 4  
VA0 C5  C5  C 0 1 Y N N 12.588 -11.775 -0.682 12.588 -11.775 -0.682 C5  VA0 5  
VA0 C6  C6  C 0 1 Y N N 12.394 -11.437 0.654  12.394 -11.437 0.654  C6  VA0 6  
VA0 C7  C7  C 0 1 Y N N 13.026 -12.109 1.695  13.026 -12.109 1.695  C7  VA0 7  
VA0 C8  C8  C 0 1 Y N N 13.878 -13.171 1.350  13.878 -13.171 1.350  C8  VA0 8  
VA0 C9  C9  C 0 1 Y N N 14.088 -13.543 0.008  14.088 -13.543 0.008  C9  VA0 9  
VA0 C10 C10 C 0 1 Y N N 13.444 -12.844 -1.029 13.444 -12.844 -1.029 C10 VA0 10 
VA0 C11 C11 C 0 1 N N N 11.757 -10.845 -1.448 11.757 -10.845 -1.448 C11 VA0 11 
VA0 C12 C12 C 0 1 N N S 10.976 -10.011 -0.439 10.976 -10.011 -0.439 C12 VA0 12 
VA0 C13 C13 C 0 1 N N N 11.132 -8.533  -0.665 11.132 -8.533  -0.665 C13 VA0 13 
VA0 C14 C14 C 0 1 N N N 12.793 -11.706 3.126  12.793 -11.706 3.126  C14 VA0 14 
VA0 C15 C15 C 0 1 N N N 15.551 -17.207 -3.007 15.551 -17.207 -3.007 C15 VA0 15 
VA0 C16 C16 C 0 1 N N N 15.417 -18.614 -2.820 15.417 -18.614 -2.820 C16 VA0 16 
VA0 C17 C17 C 0 1 N N N 14.698 -19.383 -3.655 14.698 -19.383 -3.655 C17 VA0 17 
VA0 C18 C18 C 0 1 N N N 14.042 -19.016 -4.884 14.042 -19.016 -4.884 C18 VA0 18 
VA0 C19 C19 C 0 1 N N N 12.861 -19.464 -5.287 12.861 -19.464 -5.287 C19 VA0 19 
VA0 C20 C20 C 0 1 N N S 11.739 -20.123 -4.529 11.739 -20.123 -4.529 C20 VA0 20 
VA0 C21 C21 C 0 1 N N S 11.150 -19.227 -3.426 11.150 -19.227 -3.426 C21 VA0 21 
VA0 C22 C22 C 0 1 N N R 9.799  -19.690 -2.852 9.799  -19.690 -2.852 C22 VA0 22 
VA0 C23 C23 C 0 1 N N R 9.201  -18.667 -1.865 9.201  -18.667 -1.865 C23 VA0 23 
VA0 C24 C24 C 0 1 N N R 9.143  -17.210 -2.367 9.143  -17.210 -2.367 C24 VA0 24 
VA0 C25 C25 C 0 1 N N S 8.638  -16.282 -1.248 8.638  -16.282 -1.248 C25 VA0 25 
VA0 C26 C26 C 0 1 N N R 9.058  -14.809 -1.340 9.058  -14.809 -1.340 C26 VA0 26 
VA0 C27 C27 C 0 1 N N S 8.114  -13.842 -0.591 8.114  -13.842 -0.591 C27 VA0 27 
VA0 C28 C28 C 0 1 N N N 8.289  -12.361 -0.800 8.289  -12.361 -0.800 C28 VA0 28 
VA0 C29 C29 C 0 1 N N N 9.309  -11.671 -0.319 9.309  -11.671 -0.319 C29 VA0 29 
VA0 C30 C30 C 0 1 N N N 16.061 -19.139 -1.567 16.061 -19.139 -1.567 C30 VA0 30 
VA0 C31 C31 C 0 1 N N N 10.673 -20.526 -5.538 10.673 -20.526 -5.538 C31 VA0 31 
VA0 C32 C32 C 0 1 N N N 9.930  -21.066 -2.184 9.930  -21.066 -2.184 C32 VA0 32 
VA0 C33 C33 C 0 1 N N N 8.252  -17.088 -3.610 8.252  -17.088 -3.610 C33 VA0 33 
VA0 C34 C34 C 0 1 N N N 10.513 -14.654 -0.925 10.513 -14.654 -0.925 C34 VA0 34 
VA0 C35 C35 C 0 1 N N N 6.562  -17.075 -0.314 6.562  -17.075 -0.314 C35 VA0 35 
VA0 C36 C36 C 0 1 N N N 5.085  -17.008 -0.471 5.085  -17.008 -0.471 C36 VA0 36 
VA0 C37 C37 C 0 1 N N N 6.700  -13.845 1.325  6.700  -13.845 1.325  C37 VA0 37 
VA0 N1  N1  N 0 1 N N N 15.556 -16.461 -1.877 15.556 -16.461 -1.877 N1  VA0 38 
VA0 O1  O1  O 0 1 N N N 15.683 -15.229 0.563  15.683 -15.229 0.563  O1  VA0 39 
VA0 O2  O2  O 0 1 N N N 14.499 -13.842 2.342  14.499 -13.842 2.342  O2  VA0 40 
VA0 O3  O3  O 0 1 N N N 11.545 -10.384 0.867  11.545 -10.384 0.867  O3  VA0 41 
VA0 O4  O4  O 0 1 N N N 11.614 -10.727 -2.650 11.614 -10.727 -2.650 O4  VA0 42 
VA0 O5  O5  O 0 1 N N N 9.598  -10.320 -0.473 9.598  -10.320 -0.473 O5  VA0 43 
VA0 O6  O6  O 0 1 N N N 7.990  -14.160 0.814  7.990  -14.160 0.814  O6  VA0 44 
VA0 O7  O7  O 0 1 N N N 7.184  -16.328 -1.245 7.184  -16.328 -1.245 O7  VA0 45 
VA0 O8  O8  O 0 1 N N N 7.148  -17.693 0.530  7.148  -17.693 0.530  O8  VA0 46 
VA0 O9  O9  O 0 1 N N N 9.942  -18.702 -0.651 9.942  -18.702 -0.651 O9  VA0 47 
VA0 O10 O10 O 0 1 N N N 12.095 -19.104 -2.366 12.095 -19.104 -2.366 O10 VA0 48 
VA0 O11 O11 O 0 1 N N N 15.613 -16.741 -4.151 15.613 -16.741 -4.151 O11 VA0 49 
VA0 O12 O12 O 0 1 N N N 13.230 -12.605 -3.371 13.230 -12.605 -3.371 O12 VA0 50 
VA0 H1  H1  H 0 1 N N N 14.565 -14.790 -3.741 14.565 -14.790 -3.741 H1  VA0 51 
VA0 H3  H3  H 0 1 N N N 10.549 -7.983  0.089  10.550 -7.983  0.089  H3  VA0 52 
VA0 H4  H4  H 0 1 N N N 12.194 -8.259  -0.579 12.194 -8.259  -0.579 H4  VA0 53 
VA0 H5  H5  H 0 1 N N N 10.767 -8.275  -1.670 10.767 -8.275  -1.670 H5  VA0 54 
VA0 H6  H6  H 0 1 N N N 11.939 -12.268 3.531  11.939 -12.268 3.531  H6  VA0 55 
VA0 H7  H7  H 0 1 N N N 13.692 -11.927 3.720  13.692 -11.927 3.720  H7  VA0 56 
VA0 H8  H8  H 0 1 N N N 12.578 -10.628 3.173  12.578 -10.628 3.173  H8  VA0 57 
VA0 H9  H9  H 0 1 N N N 14.598 -20.419 -3.365 14.598 -20.419 -3.365 H9  VA0 58 
VA0 H10 H10 H 0 1 N N N 14.554 -18.319 -5.530 14.554 -18.319 -5.530 H10 VA0 59 
VA0 H12 H12 H 0 1 N N N 12.671 -19.334 -6.342 12.671 -19.334 -6.342 H12 VA0 60 
VA0 H14 H14 H 0 1 N N N 12.128 -21.036 -4.055 12.128 -21.036 -4.055 H14 VA0 61 
VA0 H15 H15 H 0 1 N N N 10.990 -18.233 -3.868 10.990 -18.233 -3.868 H15 VA0 62 
VA0 H16 H16 H 0 1 N N N 9.097  -19.792 -3.692 9.097  -19.792 -3.693 H16 VA0 63 
VA0 H17 H17 H 0 1 N N N 8.168  -18.981 -1.657 8.167  -18.981 -1.657 H17 VA0 64 
VA0 H18 H18 H 0 1 N N N 10.162 -16.899 -2.640 10.162 -16.899 -2.640 H18 VA0 65 
VA0 H19 H19 H 0 1 N N N 9.008  -16.678 -0.291 9.008  -16.678 -0.291 H19 VA0 66 
VA0 H20 H20 H 0 1 N N N 9.003  -14.534 -2.404 9.003  -14.534 -2.404 H20 VA0 67 
VA0 H21 H21 H 0 1 N N N 7.123  -14.059 -1.017 7.123  -14.059 -1.017 H21 VA0 68 
VA0 H22 H22 H 0 1 N N N 7.541  -11.834 -1.374 7.541  -11.834 -1.374 H22 VA0 69 
VA0 H23 H23 H 0 1 N N N 10.014 -12.234 0.275  10.014 -12.234 0.275  H23 VA0 70 
VA0 H24 H24 H 0 1 N N N 16.591 -18.321 -1.056 16.591 -18.322 -1.056 H24 VA0 71 
VA0 H25 H25 H 0 1 N N N 15.287 -19.547 -0.900 15.287 -19.547 -0.900 H25 VA0 72 
VA0 H26 H26 H 0 1 N N N 16.776 -19.933 -1.828 16.776 -19.933 -1.827 H26 VA0 73 
VA0 H27 H27 H 0 1 N N N 9.837  -21.012 -5.014 9.837  -21.012 -5.014 H27 VA0 74 
VA0 H28 H28 H 0 1 N N N 10.307 -19.631 -6.062 10.307 -19.631 -6.062 H28 VA0 75 
VA0 H29 H29 H 0 1 N N N 11.105 -21.227 -6.268 11.105 -21.227 -6.268 H29 VA0 76 
VA0 H30 H30 H 0 1 N N N 8.953  -21.374 -1.783 8.953  -21.374 -1.783 H30 VA0 77 
VA0 H31 H31 H 0 1 N N N 10.270 -21.803 -2.926 10.270 -21.803 -2.926 H31 VA0 78 
VA0 H32 H32 H 0 1 N N N 10.661 -21.007 -1.364 10.661 -21.007 -1.364 H32 VA0 79 
VA0 H33 H33 H 0 1 N N N 8.230  -16.040 -3.944 8.230  -16.040 -3.944 H33 VA0 80 
VA0 H34 H34 H 0 1 N N N 8.656  -17.721 -4.414 8.656  -17.721 -4.414 H34 VA0 81 
VA0 H35 H35 H 0 1 N N N 7.231  -17.416 -3.363 7.231  -17.416 -3.363 H35 VA0 82 
VA0 H36 H36 H 0 1 N N N 10.804 -13.595 -0.994 10.804 -13.595 -0.994 H36 VA0 83 
VA0 H37 H37 H 0 1 N N N 10.638 -15.001 0.111  10.637 -15.001 0.111  H37 VA0 84 
VA0 H38 H38 H 0 1 N N N 11.150 -15.254 -1.592 11.150 -15.254 -1.592 H38 VA0 85 
VA0 H39 H39 H 0 1 N N N 4.605  -17.616 0.310  4.605  -17.616 0.310  H39 VA0 86 
VA0 H40 H40 H 0 1 N N N 4.754  -15.963 -0.378 4.753  -15.963 -0.378 H40 VA0 87 
VA0 H41 H41 H 0 1 N N N 4.804  -17.395 -1.461 4.804  -17.395 -1.461 H41 VA0 88 
VA0 H42 H42 H 0 1 N N N 6.655  -14.104 2.393  6.655  -14.104 2.393  H42 VA0 89 
VA0 H43 H43 H 0 1 N N N 6.509  -12.769 1.200  6.509  -12.769 1.200  H43 VA0 90 
VA0 H44 H44 H 0 1 N N N 5.938  -14.419 0.776  5.938  -14.419 0.776  H44 VA0 91 
VA0 H45 H45 H 0 1 N N N 15.073 -14.500 1.969  15.073 -14.500 1.969  H45 VA0 92 
VA0 H46 H46 H 0 1 N N N 9.578  -18.073 -0.039 9.578  -18.073 -0.039 H46 VA0 93 
VA0 H47 H47 H 0 1 N N N 11.735 -18.551 -1.683 11.735 -18.551 -1.683 H47 VA0 94 
VA0 H2  H2  H 0 1 N N N 16.011 -16.854 -1.078 16.011 -16.854 -1.078 H2  VA0 95 
# 
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 
VA0 C31 C20 SING N N 1  
VA0 C19 C18 DOUB N Z 2  
VA0 C19 C20 SING N N 3  
VA0 C18 C17 SING N N 4  
VA0 C20 C21 SING N N 5  
VA0 O11 C15 DOUB N N 6  
VA0 C17 C16 DOUB N Z 7  
VA0 C33 C24 SING N N 8  
VA0 C21 C22 SING N N 9  
VA0 C21 O10 SING N N 10 
VA0 O12 C4  DOUB N N 11 
VA0 C15 C16 SING N N 12 
VA0 C15 N1  SING N N 13 
VA0 C22 C32 SING N N 14 
VA0 C22 C23 SING N N 15 
VA0 C16 C30 SING N N 16 
VA0 C3  C4  SING N N 17 
VA0 C3  C2  DOUB N N 18 
VA0 O4  C11 DOUB N N 19 
VA0 C4  C10 SING N N 20 
VA0 C24 C23 SING N N 21 
VA0 C24 C25 SING N N 22 
VA0 N1  C2  SING N N 23 
VA0 C23 O9  SING N N 24 
VA0 C2  C1  SING N N 25 
VA0 C11 C5  SING N N 26 
VA0 C11 C12 SING N N 27 
VA0 C26 C25 SING N N 28 
VA0 C26 C34 SING N N 29 
VA0 C26 C27 SING N N 30 
VA0 C25 O7  SING N N 31 
VA0 O7  C35 SING N N 32 
VA0 C10 C5  DOUB Y N 33 
VA0 C10 C9  SING Y N 34 
VA0 C28 C27 SING N N 35 
VA0 C28 C29 DOUB N E 36 
VA0 C5  C6  SING Y N 37 
VA0 C13 C12 SING N N 38 
VA0 C27 O6  SING N N 39 
VA0 O5  C12 SING N N 40 
VA0 O5  C29 SING N N 41 
VA0 C36 C35 SING N N 42 
VA0 C12 O3  SING N N 43 
VA0 C1  C9  SING N N 44 
VA0 C1  O1  DOUB N N 45 
VA0 C35 O8  DOUB N N 46 
VA0 C9  C8  DOUB Y N 47 
VA0 C6  O3  SING N N 48 
VA0 C6  C7  DOUB Y N 49 
VA0 O6  C37 SING N N 50 
VA0 C8  C7  SING Y N 51 
VA0 C8  O2  SING N N 52 
VA0 C7  C14 SING N N 53 
VA0 C3  H1  SING N N 54 
VA0 C13 H3  SING N N 55 
VA0 C13 H4  SING N N 56 
VA0 C13 H5  SING N N 57 
VA0 C14 H6  SING N N 58 
VA0 C14 H7  SING N N 59 
VA0 C14 H8  SING N N 60 
VA0 C17 H9  SING N N 61 
VA0 C18 H10 SING N N 62 
VA0 C19 H12 SING N N 63 
VA0 C20 H14 SING N N 64 
VA0 C21 H15 SING N N 65 
VA0 C22 H16 SING N N 66 
VA0 C23 H17 SING N N 67 
VA0 C24 H18 SING N N 68 
VA0 C25 H19 SING N N 69 
VA0 C26 H20 SING N N 70 
VA0 C27 H21 SING N N 71 
VA0 C28 H22 SING N N 72 
VA0 C29 H23 SING N N 73 
VA0 C30 H24 SING N N 74 
VA0 C30 H25 SING N N 75 
VA0 C30 H26 SING N N 76 
VA0 C31 H27 SING N N 77 
VA0 C31 H28 SING N N 78 
VA0 C31 H29 SING N N 79 
VA0 C32 H30 SING N N 80 
VA0 C32 H31 SING N N 81 
VA0 C32 H32 SING N N 82 
VA0 C33 H33 SING N N 83 
VA0 C33 H34 SING N N 84 
VA0 C33 H35 SING N N 85 
VA0 C34 H36 SING N N 86 
VA0 C34 H37 SING N N 87 
VA0 C34 H38 SING N N 88 
VA0 C36 H39 SING N N 89 
VA0 C36 H40 SING N N 90 
VA0 C36 H41 SING N N 91 
VA0 C37 H42 SING N N 92 
VA0 C37 H43 SING N N 93 
VA0 C37 H44 SING N N 94 
VA0 O2  H45 SING N N 95 
VA0 O9  H46 SING N N 96 
VA0 O10 H47 SING N N 97 
VA0 N1  H2  SING N N 98 
# 
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 
VA0 SMILES           ACDLabs              12.01 "CC(=O)OC1C(C)C(OC)C=COC2(C)Oc3c(C)c(O)c4C(=O)C(=CC(=O)c4c3C2=O)NC(=O)C(C)=CC=CC(C)C(O)C(C)C(O)C1C"                                                                                                                                                                                              
VA0 InChI            InChI                1.06  "InChI=1S/C37H45NO12/c1-16-11-10-12-17(2)36(46)38-23-15-24(40)26-27(32(23)44)31(43)21(6)34-28(26)35(45)37(8,50-34)48-14-13-25(47-9)18(3)33(49-22(7)39)20(5)30(42)19(4)29(16)41/h10-16,18-20,25,29-30,33,41-43H,1-9H3,(H,38,46)/b11-10?,14-13+,17-12-/t16-,18+,19+,20+,25-,29-,30+,33+,37-/m0/s1" 
VA0 InChIKey         InChI                1.06  BTVYFIMKUHNOBZ-YVIRQOHVSA-N                                                                                                                                                                                                                                                                      
VA0 SMILES_CANONICAL CACTVS               3.385 "CO[C@H]1\C=C\O[C@@]2(C)Oc3c(C)c(O)c4C(=O)C(=CC(=O)c4c3C2=O)NC(=O)\C(=C/C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)C"                                                                                                                                                 
VA0 SMILES           CACTVS               3.385 "CO[CH]1C=CO[C]2(C)Oc3c(C)c(O)c4C(=O)C(=CC(=O)c4c3C2=O)NC(=O)C(=CC=C[CH](C)[CH](O)[CH](C)[CH](O)[CH](C)[CH](OC(C)=O)[CH]1C)C"                                                                                                                                                                    
VA0 SMILES_CANONICAL "OpenEye OEToolkits" 2.0.7 "Cc1c(c2c3c4c1O[C@@](C4=O)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](/C=C\C=C(/C(=O)NC(=CC3=O)C2=O)\C)C)O)C)O)C)OC(=O)C)C)OC)C)O"                                                                                                                                                
VA0 SMILES           "OpenEye OEToolkits" 2.0.7 "Cc1c(c2c3c4c1OC(C4=O)(OC=CC(C(C(C(C(C(C(C(C=CC=C(C(=O)NC(=CC3=O)C2=O)C)C)O)C)O)C)OC(=O)C)C)OC)C)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 
VA0 "SYSTEMATIC NAME" ACDLabs              12.01 "(2S,12Z,14Z,16S,17S,18R,19R,20R,21S,22R,23S,24E)-5,17,19-trihydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,6,9,11-tetraoxo-1,2,6,9-tetrahydro-2,7-(epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan-21-yl acetate"                                                                           
VA0 "SYSTEMATIC NAME" "OpenEye OEToolkits" 2.0.7 "[(4~{Z},6~{Z},8~{S},9~{S},10~{R},11~{R},12~{R},13~{S},14~{R},15~{S},16~{E},19~{S})-15-methoxy-4,8,10,12,14,19,28-heptamethyl-9,11,27-tris(oxidanyl)-3,20,23,25-tetrakis(oxidanylidene)-18,30-dioxa-2-azatetracyclo[17.6.5.0^{21,29}.0^{22,26}]triaconta-1(24),4,6,16,21,26,28-heptaen-13-yl] ethanoate" 
# 
loop_
_pdbx_chem_comp_audit.comp_id 
_pdbx_chem_comp_audit.action_type 
_pdbx_chem_comp_audit.date 
_pdbx_chem_comp_audit.processing_site 
VA0 "Create component" 2022-08-18 RCSB 
VA0 "Initial release"  2023-03-15 RCSB 
# 
_pdbx_chem_comp_synonyms.ordinal      1 
_pdbx_chem_comp_synonyms.comp_id      VA0 
_pdbx_chem_comp_synonyms.name         "(2S,12Z,14Z,16S,17S,18R,19R,20R,21S,22R,23S,24E)-5,17,19-trihydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,6,9,11-tetraoxo-1,2,6,9-tetrahydro-2,7-(epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan-21-yl acetate" 
_pdbx_chem_comp_synonyms.provenance   PDB 
_pdbx_chem_comp_synonyms.type         ? 
# 
