
 CHEMBL1791238

482484  0  0  0  0  0  0  0  0999 V2000
  -13.2721  -12.7111  -23.3427 C   0  0  0  0  0
  -13.0620  -12.5242  -24.8392 C   0  0  0  0  0
  -13.0333  -13.8491  -25.6439 C   0  0  0  0  0
  -14.3839  -14.5707  -25.5563 C   0  0  0  0  0
  -12.6163  -13.5561  -27.1116 C   0  0  0  0  0
  -11.1231  -13.2129  -27.2551 C   0  0  0  0  0
  -10.8176  -12.0231  -27.4231 O   0  0  0  0  0
  -10.0854  -14.0678  -27.1277 N   0  0  0  0  0
   -9.8694  -15.5270  -27.0873 C   0  0  0  0  0
  -10.7053  -16.3156  -26.0725 C   0  0  0  0  0
  -10.2599  -17.7518  -25.8916 C   0  0  0  0  0
   -9.2229  -18.0707  -25.0049 C   0  0  0  0  0
   -8.8246  -19.3978  -24.8296 C   0  0  0  0  0
   -9.4545  -20.4174  -25.5415 C   0  0  0  0  0
  -10.4835  -20.1103  -26.4297 C   0  0  0  0  0
  -10.8826  -18.7843  -26.6069 C   0  0  0  0  0
   -9.9907  -16.1253  -28.4962 C   0  0  0  0  0
  -11.1026  -16.2456  -29.0203 O   0  0  0  0  0
   -8.9076  -16.5459  -29.2085 N   0  0  0  0  0
   -7.4540  -16.3183  -29.0283 C   0  0  0  0  0
   -7.0674  -14.8342  -29.2082 C   0  0  0  0  0
   -5.5687  -14.5655  -29.0987 C   0  0  0  0  0
   -7.4927  -14.4005  -30.5119 O   0  0  0  0  0
   -6.9481  -16.9414  -27.7200 C   0  0  0  0  0
   -6.6599  -16.2435  -26.7420 O   0  0  0  0  0
   -6.8922  -18.2885  -27.5343 N   0  0  0  0  0
   -6.7659  -19.4173  -28.4808 C   0  0  0  0  0
   -7.8304  -19.4795  -29.5696 C   0  0  0  0  0
   -7.8690  -20.8513  -30.1925 C   0  0  0  0  0
   -7.2210  -21.1511  -31.1883 O   0  0  0  0  0
   -8.6821  -21.7549  -29.5771 N   0  0  0  0  0
   -5.3484  -19.3218  -29.0644 C   0  0  0  0  0
   -5.0744  -18.4581  -29.9068 O   0  0  0  0  0
   -4.3114  -20.0553  -28.5801 N   0  0  0  0  0
   -4.1691  -21.0843  -27.5334 C   0  0  0  0  0
   -4.6050  -20.6772  -26.1191 C   0  0  0  0  0
   -3.6167  -19.8628  -25.4911 O   0  0  0  0  0
   -4.8109  -22.4268  -27.8983 C   0  0  0  0  0
   -5.9312  -22.4838  -28.4113 O   0  0  0  0  0
   -4.2349  -23.6108  -27.5533 N   0  0  0  0  0
   -2.8799  -23.9802  -27.1025 C   0  0  0  0  0
   -1.7576  -23.6305  -28.0975 C   0  0  0  0  0
   -0.4504  -24.2930  -27.7115 C   0  0  0  0  0
   -0.2286  -25.6469  -27.9993 C   0  0  0  0  0
    0.9344  -26.2816  -27.5610 C   0  0  0  0  0
    1.8802  -25.5656  -26.8391 C   0  0  0  0  0
    1.6876  -24.2185  -26.5542 C   0  0  0  0  0
    0.5224  -23.5836  -26.9907 C   0  0  0  0  0
    2.9919  -26.2302  -26.4140 O   0  0  0  0  0
   -2.5682  -23.4535  -25.6891 C   0  0  0  0  0
   -2.2306  -22.2775  -25.5029 O   0  0  0  0  0
   -2.7340  -24.2226  -24.5815 N   0  0  0  0  0
   -3.2573  -25.5825  -24.3740 C   0  0  0  0  0
   -4.7178  -25.7298  -24.8262 C   0  0  0  0  0
   -5.3652  -26.9873  -24.2330 C   0  0  0  0  0
   -6.8409  -27.0899  -24.6110 C   0  0  0  0  0
   -7.3832  -28.3646  -24.1560 N   0  0  0  0  0
   -7.8154  -28.4969  -22.9621 C   0  0  0  0  0
   -7.8647  -27.6131  -21.9428 N   0  0  0  0  0
   -8.3046  -29.6884  -22.5571 N   0  0  0  0  0
   -2.3334  -26.6573  -24.9827 C   0  0  0  0  0
   -2.5113  -27.0752  -26.1321 O   0  0  0  0  0
   -1.2457  -27.1409  -24.3311 N   0  0  0  0  0
   -0.7555  -27.0338  -22.9550 C   0  0  0  0  0
   -0.3717  -25.5939  -22.5860 C   0  0  0  0  0
    0.5073  -25.5327  -21.3334 C   0  0  0  0  0
    0.9781  -24.1044  -21.0515 C   0  0  0  0  0
    1.8433  -24.0468  -19.7935 C   0  0  0  0  0
    2.3038  -22.6845  -19.5624 N   0  0  0  0  0
   -1.7479  -27.6572  -21.9459 C   0  0  0  0  0
   -2.7340  -27.0233  -21.5573 O   0  0  0  0  0
   -1.6177  -28.9103  -21.4414 N   0  0  0  0  0
   -0.7316  -30.0500  -21.6855 C   0  0  0  0  0
   -1.1081  -30.9475  -22.8921 C   0  0  0  0  0
   -1.0101  -30.3108  -24.2689 C   0  0  0  0  0
   -0.3072  -32.2572  -22.8785 C   0  0  0  0  0
    0.7717  -29.7468  -21.4867 C   0  0  0  0  0
    1.5404  -29.5882  -22.4400 O   0  0  0  0  0
    1.3209  -29.6692  -20.2404 N   0  0  0  0  0
    0.7309  -29.6265  -18.8869 C   0  0  0  0  0
    0.1239  -28.2480  -18.5890 C   0  0  0  0  0
   -0.1019  -27.9369  -17.0936 C   0  0  0  0  0
    1.2080  -27.8497  -16.3082 C   0  0  0  0  0
   -0.8675  -26.6168  -16.9576 C   0  0  0  0  0
   -0.2172  -30.8114  -18.5731 C   0  0  0  0  0
   -1.3937  -30.6424  -18.2506 O   0  0  0  0  0
    0.2560  -32.0873  -18.6700 N   0  0  0  0  0
    1.6142  -32.5272  -18.9428 C   0  0  0  0  0
    1.6070  -33.9490  -19.4968 C   0  0  0  0  0
    0.6527  -34.7065  -19.3012 O   0  0  0  0  0
    2.6950  -34.4371  -20.1569 N   0  0  0  0  0
    3.8291  -33.7442  -20.7878 C   0  0  0  0  0
    3.4035  -32.8501  -21.9615 C   0  0  0  0  0
    4.6045  -32.2360  -22.6835 C   0  0  0  0  0
    4.2748  -31.7975  -24.0912 C   0  0  0  0  0
    4.8382  -32.2617  -25.0764 O   0  0  0  0  0
    3.3286  -30.8309  -24.2166 N   0  0  0  0  0
    4.6956  -33.0062  -19.7472 C   0  0  0  0  0
    4.3981  -31.8742  -19.3513 O   0  0  0  0  0
    5.7727  -33.5956  -19.1644 N   0  0  0  0  0
    6.4140  -34.9034  -19.3632 C   0  0  0  0  0
    5.4976  -36.0785  -18.9851 C   0  0  0  0  0
    6.2335  -37.4259  -18.8085 C   0  0  0  0  0
    7.1850  -37.4263  -17.6103 C   0  0  0  0  0
    5.2093  -38.5528  -18.6410 C   0  0  0  0  0
    6.9834  -34.9995  -20.7972 C   0  0  0  0  0
    6.3958  -35.6249  -21.6836 O   0  0  0  0  0
    8.1127  -34.3332  -21.1624 N   0  0  0  0  0
    9.1340  -33.6374  -20.3664 C   0  0  0  0  0
    8.6428  -32.3347  -19.7188 C   0  0  0  0  0
    9.6888  -31.3652  -19.6403 O   0  0  0  0  0
    9.7300  -34.6157  -19.3430 C   0  0  0  0  0
    9.6756  -34.3974  -18.1289 O   0  0  0  0  0
   10.2737  -35.8081  -19.7306 N   0  0  0  0  0
   11.1532  -36.0793  -20.8773 C   0  0  0  0  0
   10.6292  -35.7981  -22.2752 C   0  0  0  0  0
   12.4661  -35.3340  -20.5998 C   0  0  0  0  0
   12.5324  -34.1070  -20.7307 O   0  0  0  0  0
   13.5411  -35.9647  -20.0537 N   0  0  0  0  0
   13.8453  -37.3900  -19.8529 C   0  0  0  0  0
   12.8648  -38.1232  -18.9253 C   0  0  0  0  0
   13.5019  -39.3707  -18.3007 C   0  0  0  0  0
   12.5103  -40.1103  -17.4046 C   0  0  0  0  0
   13.1338  -41.3089  -16.8561 N   0  0  0  0  0
   13.7969  -41.2495  -15.7665 C   0  0  0  0  0
   14.0710  -40.2031  -14.9583 N   0  0  0  0  0
   14.3730  -42.3673  -15.2744 N   0  0  0  0  0
   13.9876  -38.0330  -21.2451 C   0  0  0  0  0
   13.0035  -38.4513  -21.8631 O   0  0  0  0  0
   15.1702  -38.0202  -21.9192 N   0  0  0  0  0
   16.5486  -37.8264  -21.4524 C   0  0  0  0  0
   16.8457  -36.4308  -20.8885 C   0  0  0  0  0
   18.3519  -36.1351  -20.9064 C   0  0  0  0  0
   18.6581  -34.7469  -20.3411 C   0  0  0  0  0
   20.1592  -34.4622  -20.3669 C   0  0  0  0  0
   20.4315  -33.1406  -19.8142 N   0  0  0  0  0
   16.8608  -38.9753  -20.4775 C   0  0  0  0  0
   16.6986  -38.8495  -19.2602 O   0  0  0  0  0
   17.1750  -40.2228  -20.9292 N   0  0  0  0  0
   17.8321  -40.6378  -22.1775 C   0  0  0  0  0
   16.9816  -40.4345  -23.4420 C   0  0  0  0  0
   17.3973  -41.3626  -24.6057 C   0  0  0  0  0
   16.9144  -42.8001  -24.3913 C   0  0  0  0  0
   16.8314  -40.8336  -25.9265 C   0  0  0  0  0
   19.1968  -39.9220  -22.2150 C   0  0  0  0  0
   19.3537  -38.8692  -22.8411 O   0  0  0  0  0
   20.2345  -40.3165  -21.4209 N   0  0  0  0  0
   20.5925  -41.6487  -20.9080 C   0  0  0  0  0
   19.5700  -42.2990  -19.9621 C   0  0  0  0  0
   20.1870  -43.3752  -19.0403 C   0  0  0  0  0
   20.9153  -42.7472  -17.8488 C   0  0  0  0  0
   19.0936  -44.3126  -18.5184 C   0  0  0  0  0
   20.9056  -42.4973  -22.1542 C   0  0  0  0  0
   20.0074  -43.0638  -22.7843 O   0  0  0  0  0
   22.1524  -42.5185  -22.7042 N   0  0  0  0  0
   23.4632  -42.1594  -22.1449 C   0  0  0  0  0
   23.6383  -40.6640  -21.8652 C   0  0  0  0  0
   25.1195  -40.2877  -21.7926 C   0  0  0  0  0
   25.2728  -38.8622  -21.3262 C   0  0  0  0  0
   25.3693  -37.9092  -22.0890 O   0  0  0  0  0
   25.2274  -38.6927  -19.9750 N   0  0  0  0  0
   23.6971  -43.0526  -20.9146 C   0  0  0  0  0
   23.6468  -42.5969  -19.7691 O   0  0  0  0  0
   23.8287  -44.4075  -21.0370 N   0  0  0  0  0
   24.5994  -45.1706  -22.0404 C   0  0  0  0  0
   24.0509  -45.0692  -23.4692 C   0  0  0  0  0
   24.5529  -46.1572  -24.4050 C   0  0  0  0  0
   26.0694  -44.7153  -21.9059 C   0  0  0  0  0
   26.3729  -43.5374  -22.1340 O   0  0  0  0  0
   27.0740  -45.5352  -21.4984 N   0  0  0  0  0
   27.1459  -46.9419  -21.0635 C   0  0  0  0  0
   26.8269  -47.2047  -19.5658 C   0  0  0  0  0
   25.4470  -46.7596  -19.1009 C   0  0  0  0  0
   27.1016  -48.6847  -19.2057 C   0  0  0  0  0
   27.1822  -48.9491  -17.7072 C   0  0  0  0  0
   26.4994  -47.8688  -22.1061 C   0  0  0  0  0
   25.4033  -48.4019  -21.9173 O   0  0  0  0  0
   27.0577  -48.0441  -23.3435 N   0  0  0  0  0
   28.4706  -48.0045  -23.7723 C   0  0  0  0  0
   29.1853  -46.6623  -23.5831 C   0  0  0  0  0
   30.5082  -46.5994  -24.3505 C   0  0  0  0  0
   31.2650  -44.9633  -24.0679 S   0  0  0  0  0
   32.9103  -45.2940  -24.7395 C   0  0  0  0  0
   29.1386  -49.1856  -23.0544 C   0  0  0  0  0
   29.7380  -49.0307  -21.9871 O   0  0  0  0  0
   28.9258  -50.4711  -23.4661 N   0  0  0  0  0
   28.7384  -51.0248  -24.8207 C   0  0  0  0  0
   27.5385  -50.5362  -25.6372 C   0  0  0  0  0
   27.2267  -51.4940  -26.6506 O   0  0  0  0  0
   30.0580  -50.7951  -25.5714 C   0  0  0  0  0
   30.3761  -49.6662  -25.9610 O   0  0  0  0  0
   30.9753  -51.7980  -25.7042 N   0  0  0  0  0
   30.9465  -53.1935  -25.2318 C   0  0  0  0  0
   30.8313  -53.3318  -23.7075 C   0  0  0  0  0
   31.3794  -54.6721  -23.2079 C   0  0  0  0  0
   31.1239  -54.8562  -21.7129 C   0  0  0  0  0
   31.5819  -56.1774  -21.3060 N   0  0  0  0  0
   32.7836  -56.3580  -20.9188 C   0  0  0  0  0
   33.8086  -55.4872  -20.7945 N   0  0  0  0  0
   33.1932  -57.5982  -20.5771 N   0  0  0  0  0
   29.8961  -54.0063  -26.0186 C   0  0  0  0  0
   29.1113  -54.7975  -25.5091 O   0  0  0  0  0
   29.9688  -53.8781  -27.3781 N   0  0  0  0  0
  -13.0608  -14.5354  -28.0940 N   0  0  0  0  0
  -13.8164  -14.3715  -29.2168 C   0  0  0  0  0
  -14.1026  -15.3760  -29.8765 O   0  0  0  0  0
  -14.3569  -12.9980  -29.6678 C   0  0  0  0  0
  -15.3865  -12.3939  -28.7213 C   0  0  0  0  0
  -13.2623  -12.0725  -29.9766 N   0  0  0  0  0
  -12.7126  -11.7823  -31.1937 C   0  0  0  0  0
  -11.5357  -11.4175  -31.2289 O   0  0  0  0  0
  -13.5238  -11.9038  -32.4975 C   0  0  0  0  0
  -13.7190  -13.3585  -32.9168 C   0  0  0  0  0
  -13.1919  -13.5348  -34.3114 C   0  0  0  0  0
  -13.2737  -12.7188  -35.2164 O   0  0  0  0  0
  -12.6093  -14.7301  -34.5054 O   0  0  0  0  0
  -14.7828  -11.1665  -32.3328 N   0  0  0  0  0
  -14.9164   -9.8209  -32.5515 C   0  0  0  0  0
  -15.4922   -9.1698  -31.6752 O   0  0  0  0  0
  -14.3726   -9.1452  -33.8311 C   0  0  0  0  0
  -12.8811   -8.8444  -33.7954 C   0  0  0  0  0
  -14.7469   -9.9345  -35.0052 N   0  0  0  0  0
  -15.8683   -9.8105  -35.7772 C   0  0  0  0  0
  -16.1753  -10.7552  -36.5113 O   0  0  0  0  0
  -16.7348   -8.5295  -35.7667 C   0  0  0  0  0
  -17.6303   -8.4606  -34.5177 C   0  0  0  0  0
  -18.6963   -7.3893  -34.5949 C   0  0  0  0  0
  -19.9372   -7.6583  -35.1869 C   0  0  0  0  0
  -20.9137   -6.6631  -35.2573 C   0  0  0  0  0
  -20.6505   -5.3993  -34.7426 C   0  0  0  0  0
  -19.4239   -5.1105  -34.1547 C   0  0  0  0  0
  -18.4489   -6.1070  -34.0802 C   0  0  0  0  0
  -21.6329   -4.4577  -34.8332 O   0  0  0  0  0
  -15.8848   -7.3295  -35.9665 N   0  0  0  0  0
  -13.1647  -11.7502  -22.8287 H   0  0  0  0  0
  -12.5334  -13.4020  -22.9251 H   0  0  0  0  0
  -14.2727  -13.0907  -23.1188 H   0  0  0  0  0
  -12.1116  -11.9946  -24.9745 H   0  0  0  0  0
  -13.8480  -11.8657  -25.2291 H   0  0  0  0  0
  -12.2890  -14.4853  -25.1665 H   0  0  0  0  0
  -15.1877  -13.9616  -25.9817 H   0  0  0  0  0
  -14.6467  -14.8016  -24.5197 H   0  0  0  0  0
  -14.3581  -15.5278  -26.0873 H   0  0  0  0  0
  -13.1168  -12.6245  -27.3704 H   0  0  0  0  0
   -9.2321  -13.5411  -27.2818 H   0  0  0  0  0
   -8.8392  -15.6013  -26.7582 H   0  0  0  0  0
  -11.7643  -16.3225  -26.3457 H   0  0  0  0  0
  -10.6426  -15.8250  -25.0932 H   0  0  0  0  0
   -8.7178  -17.2867  -24.4429 H   0  0  0  0  0
   -8.0266  -19.6330  -24.1298 H   0  0  0  0  0
   -9.1532  -21.4509  -25.3933 H   0  0  0  0  0
  -10.9900  -20.9016  -26.9768 H   0  0  0  0  0
  -11.6907  -18.5638  -27.3037 H   0  0  0  0  0
   -9.1834  -16.7700  -30.1583 H   0  0  0  0  0
   -6.9856  -16.8536  -29.8571 H   0  0  0  0  0
   -7.5904  -14.2040  -28.4862 H   0  0  0  0  0
   -4.9991  -15.2386  -29.7481 H   0  0  0  0  0
   -5.2058  -14.6817  -28.0744 H   0  0  0  0  0
   -5.3406  -13.5442  -29.4237 H   0  0  0  0  0
   -6.8898  -14.7841  -31.1739 H   0  0  0  0  0
   -6.5542  -18.4702  -26.5975 H   0  0  0  0  0
   -6.8522  -20.3085  -27.8580 H   0  0  0  0  0
   -7.6578  -18.7752  -30.3878 H   0  0  0  0  0
   -8.8211  -19.2634  -29.1544 H   0  0  0  0  0
   -8.9854  -21.6264  -28.6226 H   0  0  0  0  0
   -8.5993  -22.7079  -29.9104 H   0  0  0  0  0
   -3.4529  -19.8035  -29.0561 H   0  0  0  0  0
   -3.0892  -21.2305  -27.5191 H   0  0  0  0  0
   -4.7657  -21.5500  -25.4767 H   0  0  0  0  0
   -5.5406  -20.1258  -26.1072 H   0  0  0  0  0
   -2.8465  -20.4503  -25.3274 H   0  0  0  0  0
   -4.7915  -24.3884  -27.8943 H   0  0  0  0  0
   -2.9282  -25.0637  -27.0606 H   0  0  0  0  0
   -1.5996  -22.5503  -28.1761 H   0  0  0  0  0
   -2.0374  -23.9609  -29.1064 H   0  0  0  0  0
   -0.9715  -26.2280  -28.5428 H   0  0  0  0  0
    1.0960  -27.3335  -27.7788 H   0  0  0  0  0
    2.4199  -23.6516  -25.9877 H   0  0  0  0  0
    0.3702  -22.5338  -26.7450 H   0  0  0  0  0
    3.6062  -25.5866  -26.0236 H   0  0  0  0  0
   -2.5197  -23.7085  -23.7353 H   0  0  0  0  0
   -3.2558  -25.6923  -23.2931 H   0  0  0  0  0
   -4.7931  -25.7783  -25.9166 H   0  0  0  0  0
   -5.2880  -24.8480  -24.5072 H   0  0  0  0  0
   -5.2658  -26.9746  -23.1410 H   0  0  0  0  0
   -4.8363  -27.8816  -24.5846 H   0  0  0  0  0
   -6.9423  -27.0554  -25.7021 H   0  0  0  0  0
   -7.4108  -26.2351  -24.2292 H   0  0  0  0  0
   -7.7282  -26.6473  -22.2060 H   0  0  0  0  0
   -8.6951  -27.7264  -21.3730 H   0  0  0  0  0
   -8.1201  -30.3915  -23.2668 H   0  0  0  0  0
   -7.9237  -29.9768  -21.6643 H   0  0  0  0  0
   -0.6951  -27.7300  -24.9453 H   0  0  0  0  0
    0.1601  -27.6265  -22.9483 H   0  0  0  0  0
   -1.2612  -24.9843  -22.4054 H   0  0  0  0  0
    0.1664  -25.1361  -23.4258 H   0  0  0  0  0
    1.3779  -26.1880  -21.4560 H   0  0  0  0  0
   -0.0629  -25.8986  -20.4732 H   0  0  0  0  0
    0.1060  -23.4485  -20.9342 H   0  0  0  0  0
    1.5484  -23.7321  -21.9121 H   0  0  0  0  0
    2.7128  -24.7036  -19.9042 H   0  0  0  0  0
    1.2734  -24.3920  -18.9242 H   0  0  0  0  0
    1.5049  -22.0669  -19.4209 H   0  0  0  0  0
    2.8456  -22.6487  -18.6995 H   0  0  0  0  0
   -2.3998  -29.1184  -20.8263 H   0  0  0  0  0
   -0.9815  -30.7037  -20.8474 H   0  0  0  0  0
   -2.1623  -31.2302  -22.7588 H   0  0  0  0  0
   -0.0452  -29.8261  -24.4345 H   0  0  0  0  0
   -1.8168  -29.5883  -24.4009 H   0  0  0  0  0
   -1.1402  -31.0601  -25.0580 H   0  0  0  0  0
    0.7413  -32.0877  -23.1365 H   0  0  0  0  0
   -0.7144  -32.9651  -23.6088 H   0  0  0  0  0
   -0.3487  -32.7385  -21.8961 H   0  0  0  0  0
    2.3093  -29.4431  -20.2800 H   0  0  0  0  0
    1.5963  -29.7663  -18.2290 H   0  0  0  0  0
   -0.8330  -28.1492  -19.1094 H   0  0  0  0  0
    0.7844  -27.4759  -19.0038 H   0  0  0  0  0
   -0.7181  -28.7235  -16.6438 H   0  0  0  0  0
    1.8945  -27.1252  -16.7592 H   0  0  0  0  0
    1.7139  -28.8184  -16.2631 H   0  0  0  0  0
    1.0204  -27.5378  -15.2749 H   0  0  0  0  0
   -0.2978  -25.7814  -17.3785 H   0  0  0  0  0
   -1.0722  -26.3917  -15.9056 H   0  0  0  0  0
   -1.8290  -26.6687  -17.4794 H   0  0  0  0  0
   -0.4133  -32.8167  -18.4354 H   0  0  0  0  0
    2.1659  -32.5108  -17.9990 H   0  0  0  0  0
    2.0645  -31.8505  -19.6536 H   0  0  0  0  0
    2.5299  -35.3850  -20.4799 H   0  0  0  0  0
    4.4136  -34.5493  -21.2236 H   0  0  0  0  0
    2.7416  -32.0464  -21.6321 H   0  0  0  0  0
    2.8170  -33.4537  -22.6665 H   0  0  0  0  0
    5.4187  -32.9669  -22.7576 H   0  0  0  0  0
    4.9937  -31.3727  -22.1322 H   0  0  0  0  0
    2.8440  -30.3808  -23.4417 H   0  0  0  0  0
    3.1160  -30.4957  -25.1469 H   0  0  0  0  0
    6.1580  -33.0191  -18.4250 H   0  0  0  0  0
    7.2482  -34.8953  -18.6636 H   0  0  0  0  0
    4.7280  -36.2146  -19.7511 H   0  0  0  0  0
    4.9652  -35.8377  -18.0552 H   0  0  0  0  0
    6.8179  -37.6392  -19.7117 H   0  0  0  0  0
    6.6632  -37.1486  -16.6883 H   0  0  0  0  0
    8.0149  -36.7304  -17.7545 H   0  0  0  0  0
    7.6233  -38.4195  -17.4632 H   0  0  0  0  0
    4.5937  -38.4005  -17.7478 H   0  0  0  0  0
    5.7091  -39.5228  -18.5469 H   0  0  0  0  0
    4.5427  -38.6059  -19.5082 H   0  0  0  0  0
    8.3070  -34.4324  -22.1524 H   0  0  0  0  0
    9.9352  -33.3656  -21.0589 H   0  0  0  0  0
    8.2486  -32.4753  -18.7096 H   0  0  0  0  0
    7.8534  -31.8828  -20.3286 H   0  0  0  0  0
   10.3777  -31.7197  -19.0472 H   0  0  0  0  0
   10.5588  -36.3131  -18.8996 H   0  0  0  0  0
   11.3040  -37.1523  -20.8408 H   0  0  0  0  0
   10.5759  -34.7343  -22.5134 H   0  0  0  0  0
    9.6458  -36.2529  -22.4263 H   0  0  0  0  0
   11.3092  -36.2335  -23.0173 H   0  0  0  0  0
   14.3124  -35.3226  -19.9115 H   0  0  0  0  0
   14.8058  -37.3885  -19.3447 H   0  0  0  0  0
   11.9620  -38.4417  -19.4522 H   0  0  0  0  0
   12.5489  -37.4489  -18.1196 H   0  0  0  0  0
   14.3815  -39.0797  -17.7144 H   0  0  0  0  0
   13.8554  -40.0462  -19.0895 H   0  0  0  0  0
   11.6456  -40.4259  -18.0004 H   0  0  0  0  0
   12.1099  -39.4528  -16.6247 H   0  0  0  0  0
   13.5163  -39.3750  -15.1233 H   0  0  0  0  0
   14.0652  -40.4600  -13.9781 H   0  0  0  0  0
   14.3047  -43.1138  -15.9596 H   0  0  0  0  0
   15.3382  -42.2136  -15.0098 H   0  0  0  0  0
   15.0709  -38.4507  -22.8308 H   0  0  0  0  0
   17.1576  -37.9307  -22.3477 H   0  0  0  0  0
   16.4931  -36.3206  -19.8599 H   0  0  0  0  0
   16.3275  -35.6745  -21.4909 H   0  0  0  0  0
   18.7260  -36.1972  -21.9355 H   0  0  0  0  0
   18.8853  -36.8937  -20.3209 H   0  0  0  0  0
   18.2850  -34.6810  -19.3112 H   0  0  0  0  0
   18.1244  -33.9883  -20.9275 H   0  0  0  0  0
   20.5378  -34.5122  -21.3937 H   0  0  0  0  0
   20.6953  -35.2131  -19.7766 H   0  0  0  0  0
   19.9691  -32.4310  -20.3817 H   0  0  0  0  0
   21.4305  -32.9485  -19.8835 H   0  0  0  0  0
   17.2633  -40.8664  -20.1532 H   0  0  0  0  0
   17.9943  -41.7057  -22.0670 H   0  0  0  0  0
   17.0580  -39.4019  -23.7939 H   0  0  0  0  0
   15.9238  -40.6111  -23.2087 H   0  0  0  0  0
   18.4910  -41.3690  -24.6898 H   0  0  0  0  0
   15.8222  -42.8437  -24.3182 H   0  0  0  0  0
   17.3281  -43.2387  -23.4795 H   0  0  0  0  0
   17.2200  -43.4381  -25.2277 H   0  0  0  0  0
   15.7374  -40.7878  -25.9007 H   0  0  0  0  0
   17.1255  -41.4778  -26.7620 H   0  0  0  0  0
   17.2088  -39.8270  -26.1356 H   0  0  0  0  0
   21.0197  -39.6912  -21.5615 H   0  0  0  0  0
   21.4997  -41.4820  -20.3350 H   0  0  0  0  0
   18.7690  -42.7740  -20.5346 H   0  0  0  0  0
   19.1099  -41.5282  -19.3330 H   0  0  0  0  0
   20.9002  -43.9795  -19.6135 H   0  0  0  0  0
   20.2188  -42.2023  -17.2019 H   0  0  0  0  0
   21.6883  -42.0437  -18.1665 H   0  0  0  0  0
   21.3990  -43.5210  -17.2429 H   0  0  0  0  0
   18.3363  -43.7627  -17.9489 H   0  0  0  0  0
   19.5189  -45.0812  -17.8641 H   0  0  0  0  0
   18.5905  -44.8233  -19.3463 H   0  0  0  0  0
   22.1647  -43.0610  -23.5590 H   0  0  0  0  0
   24.1916  -42.4142  -22.9137 H   0  0  0  0  0
   23.1513  -40.3634  -20.9336 H   0  0  0  0  0
   23.1658  -40.0777  -22.6639 H   0  0  0  0  0
   25.5982  -40.3878  -22.7734 H   0  0  0  0  0
   25.6619  -40.9434  -21.1019 H   0  0  0  0  0
   25.2399  -39.4687  -19.3260 H   0  0  0  0  0
   25.3578  -37.7567  -19.6141 H   0  0  0  0  0
   23.8486  -44.8147  -20.1113 H   0  0  0  0  0
   24.4944  -46.2016  -21.7128 H   0  0  0  0  0
   24.3156  -44.1190  -23.9367 H   0  0  0  0  0
   22.9572  -45.1343  -23.4415 H   0  0  0  0  0
   25.6354  -46.0891  -24.5391 H   0  0  0  0  0
   24.0918  -46.0428  -25.3919 H   0  0  0  0  0
   24.2921  -47.1517  -24.0339 H   0  0  0  0  0
   27.9429  -45.0166  -21.4174 H   0  0  0  0  0
   28.2128  -47.1697  -21.1103 H   0  0  0  0  0
   27.5445  -46.5983  -18.9933 H   0  0  0  0  0
   24.6444  -47.2269  -19.6763 H   0  0  0  0  0
   25.3702  -45.6739  -19.1717 H   0  0  0  0  0
   25.2765  -46.9984  -18.0471 H   0  0  0  0  0
   28.0573  -48.9926  -19.6467 H   0  0  0  0  0
   26.3299  -49.3335  -19.6351 H   0  0  0  0  0
   27.9054  -48.2821  -17.2277 H   0  0  0  0  0
   27.5034  -49.9803  -17.5274 H   0  0  0  0  0
   26.2121  -48.8201  -17.2197 H   0  0  0  0  0
   26.4626  -48.6601  -23.8808 H   0  0  0  0  0
   28.4528  -48.1936  -24.8443 H   0  0  0  0  0
   29.4142  -46.4766  -22.5320 H   0  0  0  0  0
   28.5222  -45.8582  -23.9279 H   0  0  0  0  0
   30.3424  -46.7315  -25.4239 H   0  0  0  0  0
   31.1916  -47.3771  -23.9962 H   0  0  0  0  0
   33.5142  -44.3850  -24.6712 H   0  0  0  0  0
   32.8428  -45.5903  -25.7890 H   0  0  0  0  0
   33.4037  -46.0805  -24.1627 H   0  0  0  0  0
   29.3781  -51.1051  -22.8175 H   0  0  0  0  0
   28.5838  -52.0935  -24.6711 H   0  0  0  0  0
   27.7146  -49.5856  -26.1437 H   0  0  0  0  0
   26.6561  -50.4496  -24.9971 H   0  0  0  0  0
   26.3889  -51.2190  -27.0656 H   0  0  0  0  0
   31.8330  -51.4844  -26.1440 H   0  0  0  0  0
   31.9217  -53.5979  -25.5351 H   0  0  0  0  0
   29.7893  -53.2498  -23.3849 H   0  0  0  0  0
   31.3861  -52.5215  -23.2178 H   0  0  0  0  0
   32.4551  -54.7283  -23.4142 H   0  0  0  0  0
   30.9141  -55.5015  -23.7532 H   0  0  0  0  0
   30.0471  -54.8003  -21.5152 H   0  0  0  0  0
   31.5773  -54.0489  -21.1279 H   0  0  0  0  0
   33.5346  -54.5151  -20.7779 H   0  0  0  0  0
   34.3965  -55.7081  -19.9988 H   0  0  0  0  0
   32.4708  -58.2717  -20.8183 H   0  0  0  0  0
   34.0696  -57.8499  -21.0174 H   0  0  0  0  0
   30.4371  -53.0894  -27.8028 H   0  0  0  0  0
   29.2553  -54.3532  -27.9169 H   0  0  0  0  0
  -12.6302  -15.4586  -28.0986 H   0  0  0  0  0
  -14.8938  -13.2165  -30.5940 H   0  0  0  0  0
  -14.9472  -11.9318  -27.8352 H   0  0  0  0  0
  -16.1027  -13.1517  -28.3872 H   0  0  0  0  0
  -15.9470  -11.6021  -29.2311 H   0  0  0  0  0
  -12.5681  -11.9144  -29.2511 H   0  0  0  0  0
  -12.9257  -11.3778  -33.2377 H   0  0  0  0  0
  -14.7716  -13.6601  -32.9205 H   0  0  0  0  0
  -13.1609  -14.0348  -32.2591 H   0  0  0  0  0
  -12.3153  -14.7204  -35.4401 H   0  0  0  0  0
  -15.2720  -11.3769  -31.4734 H   0  0  0  0  0
  -14.8803   -8.1801  -33.8703 H   0  0  0  0  0
  -12.2643   -9.6866  -34.1188 H   0  0  0  0  0
  -12.5591   -8.5412  -32.7942 H   0  0  0  0  0
  -12.6524   -8.0251  -34.4868 H   0  0  0  0  0
  -14.3039  -10.8441  -35.1232 H   0  0  0  0  0
  -17.3787   -8.5993  -36.6542 H   0  0  0  0  0
  -17.0439   -8.2886  -33.6113 H   0  0  0  0  0
  -18.1160   -9.4326  -34.3576 H   0  0  0  0  0
  -20.1546   -8.6449  -35.5897 H   0  0  0  0  0
  -21.8782   -6.8748  -35.7098 H   0  0  0  0  0
  -19.2089   -4.1272  -33.7492 H   0  0  0  0  0
  -17.4903   -5.8818  -33.6154 H   0  0  0  0  0
  -21.3142   -3.6412  -34.4153 H   0  0  0  0  0
  -15.3707   -7.4502  -36.8404 H   0  0  0  0  0
  -16.5009   -6.5293  -36.1150 H   0  0  0  0  0
  1  2  1  0  0  0
  1235  1  0  0  0
  1236  1  0  0  0
  1237  1  0  0  0
  2  3  1  0  0  0
  2238  1  0  0  0
  2239  1  0  0  0
  3  5  1  0  0  0
  3  4  1  0  0  0
  3240  1  0  0  0
  4241  1  0  0  0
  4242  1  0  0  0
  4243  1  0  0  0
  5204  1  0  0  0
  5  6  1  0  0  0
  5244  1  0  0  0
  6  8  1  0  0  0
  6  7  2  0  0  0
  8  9  1  0  0  0
  8245  1  0  0  0
  9 17  1  0  0  0
  9 10  1  0  0  0
  9246  1  0  0  0
 10 11  1  0  0  0
 10247  1  0  0  0
 10248  1  0  0  0
 11 12  2  0  0  0
 11 16  1  0  0  0
 12 13  1  0  0  0
 12249  1  0  0  0
 13 14  2  0  0  0
 13250  1  0  0  0
 14 15  1  0  0  0
 14251  1  0  0  0
 15 16  2  0  0  0
 15252  1  0  0  0
 16253  1  0  0  0
 17 19  1  0  0  0
 17 18  2  0  0  0
 19 20  1  0  0  0
 19254  1  0  0  0
 20 24  1  0  0  0
 20 21  1  0  0  0
 20255  1  0  0  0
 21 23  1  0  0  0
 21 22  1  0  0  0
 21256  1  0  0  0
 22257  1  0  0  0
 22258  1  0  0  0
 22259  1  0  0  0
 23260  1  0  0  0
 24 26  1  0  0  0
 24 25  2  0  0  0
 26 27  1  0  0  0
 26261  1  0  0  0
 27 32  1  0  0  0
 27 28  1  0  0  0
 27262  1  0  0  0
 28 29  1  0  0  0
 28263  1  0  0  0
 28264  1  0  0  0
 29 31  1  0  0  0
 29 30  2  0  0  0
 31265  1  0  0  0
 31266  1  0  0  0
 32 34  1  0  0  0
 32 33  2  0  0  0
 34 35  1  0  0  0
 34267  1  0  0  0
 35 38  1  0  0  0
 35 36  1  0  0  0
 35268  1  0  0  0
 36 37  1  0  0  0
 36269  1  0  0  0
 36270  1  0  0  0
 37271  1  0  0  0
 38 40  1  0  0  0
 38 39  2  0  0  0
 40 41  1  0  0  0
 40272  1  0  0  0
 41 50  1  0  0  0
 41 42  1  0  0  0
 41273  1  0  0  0
 42 43  1  0  0  0
 42274  1  0  0  0
 42275  1  0  0  0
 43 44  2  0  0  0
 43 48  1  0  0  0
 44 45  1  0  0  0
 44276  1  0  0  0
 45 46  2  0  0  0
 45277  1  0  0  0
 46 47  1  0  0  0
 46 49  1  0  0  0
 47 48  2  0  0  0
 47278  1  0  0  0
 48279  1  0  0  0
 49280  1  0  0  0
 50 52  1  0  0  0
 50 51  2  0  0  0
 52 53  1  0  0  0
 52281  1  0  0  0
 53 61  1  0  0  0
 53 54  1  0  0  0
 53282  1  0  0  0
 54 55  1  0  0  0
 54283  1  0  0  0
 54284  1  0  0  0
 55 56  1  0  0  0
 55285  1  0  0  0
 55286  1  0  0  0
 56 57  1  0  0  0
 56287  1  0  0  0
 56288  1  0  0  0
 57 58  2  0  0  0
 58 60  1  0  0  0
 58 59  1  0  0  0
 59289  1  0  0  0
 59290  1  0  0  0
 60291  1  0  0  0
 60292  1  0  0  0
 61 63  1  0  0  0
 61 62  2  0  0  0
 63 64  1  0  0  0
 63293  1  0  0  0
 64 70  1  0  0  0
 64 65  1  0  0  0
 64294  1  0  0  0
 65 66  1  0  0  0
 65295  1  0  0  0
 65296  1  0  0  0
 66 67  1  0  0  0
 66297  1  0  0  0
 66298  1  0  0  0
 67 68  1  0  0  0
 67299  1  0  0  0
 67300  1  0  0  0
 68 69  1  0  0  0
 68301  1  0  0  0
 68302  1  0  0  0
 69303  1  0  0  0
 69304  1  0  0  0
 70 72  1  0  0  0
 70 71  2  0  0  0
 72 73  1  0  0  0
 72305  1  0  0  0
 73 77  1  0  0  0
 73 74  1  0  0  0
 73306  1  0  0  0
 74 76  1  0  0  0
 74 75  1  0  0  0
 74307  1  0  0  0
 75308  1  0  0  0
 75309  1  0  0  0
 75310  1  0  0  0
 76311  1  0  0  0
 76312  1  0  0  0
 76313  1  0  0  0
 77 79  1  0  0  0
 77 78  2  0  0  0
 79 80  1  0  0  0
 79314  1  0  0  0
 80 85  1  0  0  0
 80 81  1  0  0  0
 80315  1  0  0  0
 81 82  1  0  0  0
 81316  1  0  0  0
 81317  1  0  0  0
 82 84  1  0  0  0
 82 83  1  0  0  0
 82318  1  0  0  0
 83319  1  0  0  0
 83320  1  0  0  0
 83321  1  0  0  0
 84322  1  0  0  0
 84323  1  0  0  0
 84324  1  0  0  0
 85 87  1  0  0  0
 85 86  2  0  0  0
 87 88  1  0  0  0
 87325  1  0  0  0
 88 89  1  0  0  0
 88326  1  0  0  0
 88327  1  0  0  0
 89 91  1  0  0  0
 89 90  2  0  0  0
 91 92  1  0  0  0
 91328  1  0  0  0
 92 98  1  0  0  0
 92 93  1  0  0  0
 92329  1  0  0  0
 93 94  1  0  0  0
 93330  1  0  0  0
 93331  1  0  0  0
 94 95  1  0  0  0
 94332  1  0  0  0
 94333  1  0  0  0
 95 97  1  0  0  0
 95 96  2  0  0  0
 97334  1  0  0  0
 97335  1  0  0  0
 98100  1  0  0  0
 98 99  2  0  0  0
100101  1  0  0  0
100336  1  0  0  0
101106  1  0  0  0
101102  1  0  0  0
101337  1  0  0  0
102103  1  0  0  0
102338  1  0  0  0
102339  1  0  0  0
103105  1  0  0  0
103104  1  0  0  0
103340  1  0  0  0
104341  1  0  0  0
104342  1  0  0  0
104343  1  0  0  0
105344  1  0  0  0
105345  1  0  0  0
105346  1  0  0  0
106108  1  0  0  0
106107  2  0  0  0
108109  1  0  0  0
108347  1  0  0  0
109112  1  0  0  0
109110  1  0  0  0
109348  1  0  0  0
110111  1  0  0  0
110349  1  0  0  0
110350  1  0  0  0
111351  1  0  0  0
112114  1  0  0  0
112113  2  0  0  0
114115  1  0  0  0
114352  1  0  0  0
115117  1  0  0  0
115116  1  0  0  0
115353  1  0  0  0
116354  1  0  0  0
116355  1  0  0  0
116356  1  0  0  0
117119  1  0  0  0
117118  2  0  0  0
119120  1  0  0  0
119357  1  0  0  0
120128  1  0  0  0
120121  1  0  0  0
120358  1  0  0  0
121122  1  0  0  0
121359  1  0  0  0
121360  1  0  0  0
122123  1  0  0  0
122361  1  0  0  0
122362  1  0  0  0
123124  1  0  0  0
123363  1  0  0  0
123364  1  0  0  0
124125  2  0  0  0
125127  1  0  0  0
125126  1  0  0  0
126365  1  0  0  0
126366  1  0  0  0
127367  1  0  0  0
127368  1  0  0  0
128130  1  0  0  0
128129  2  0  0  0
130131  1  0  0  0
130369  1  0  0  0
131137  1  0  0  0
131132  1  0  0  0
131370  1  0  0  0
132133  1  0  0  0
132371  1  0  0  0
132372  1  0  0  0
133134  1  0  0  0
133373  1  0  0  0
133374  1  0  0  0
134135  1  0  0  0
134375  1  0  0  0
134376  1  0  0  0
135136  1  0  0  0
135377  1  0  0  0
135378  1  0  0  0
136379  1  0  0  0
136380  1  0  0  0
137139  1  0  0  0
137138  2  0  0  0
139140  1  0  0  0
139381  1  0  0  0
140145  1  0  0  0
140141  1  0  0  0
140382  1  0  0  0
141142  1  0  0  0
141383  1  0  0  0
141384  1  0  0  0
142144  1  0  0  0
142143  1  0  0  0
142385  1  0  0  0
143386  1  0  0  0
143387  1  0  0  0
143388  1  0  0  0
144389  1  0  0  0
144390  1  0  0  0
144391  1  0  0  0
145147  1  0  0  0
145146  2  0  0  0
147148  1  0  0  0
147392  1  0  0  0
148153  1  0  0  0
148149  1  0  0  0
148393  1  0  0  0
149150  1  0  0  0
149394  1  0  0  0
149395  1  0  0  0
150152  1  0  0  0
150151  1  0  0  0
150396  1  0  0  0
151397  1  0  0  0
151398  1  0  0  0
151399  1  0  0  0
152400  1  0  0  0
152401  1  0  0  0
152402  1  0  0  0
153155  1  0  0  0
153154  2  0  0  0
155156  1  0  0  0
155403  1  0  0  0
156162  1  0  0  0
156157  1  0  0  0
156404  1  0  0  0
157158  1  0  0  0
157405  1  0  0  0
157406  1  0  0  0
158159  1  0  0  0
158407  1  0  0  0
158408  1  0  0  0
159161  1  0  0  0
159160  2  0  0  0
161409  1  0  0  0
161410  1  0  0  0
162164  1  0  0  0
162163  2  0  0  0
164165  1  0  0  0
164411  1  0  0  0
165168  1  0  0  0
165166  1  0  0  0
165412  1  0  0  0
166167  1  0  0  0
166413  1  0  0  0
166414  1  0  0  0
167415  1  0  0  0
167416  1  0  0  0
167417  1  0  0  0
168170  1  0  0  0
168169  2  0  0  0
170171  1  0  0  0
170418  1  0  0  0
171176  1  0  0  0
171172  1  0  0  0
171419  1  0  0  0
172174  1  0  0  0
172173  1  0  0  0
172420  1  0  0  0
173421  1  0  0  0
173422  1  0  0  0
173423  1  0  0  0
174175  1  0  0  0
174424  1  0  0  0
174425  1  0  0  0
175426  1  0  0  0
175427  1  0  0  0
175428  1  0  0  0
176178  1  0  0  0
176177  2  0  0  0
178179  1  0  0  0
178429  1  0  0  0
179184  1  0  0  0
179180  1  0  0  0
179430  1  0  0  0
180181  1  0  0  0
180431  1  0  0  0
180432  1  0  0  0
181182  1  0  0  0
181433  1  0  0  0
181434  1  0  0  0
182183  1  0  0  0
183435  1  0  0  0
183436  1  0  0  0
183437  1  0  0  0
184186  1  0  0  0
184185  2  0  0  0
186187  1  0  0  0
186438  1  0  0  0
187190  1  0  0  0
187188  1  0  0  0
187439  1  0  0  0
188189  1  0  0  0
188440  1  0  0  0
188441  1  0  0  0
189442  1  0  0  0
190192  1  0  0  0
190191  2  0  0  0
192193  1  0  0  0
192443  1  0  0  0
193201  1  0  0  0
193194  1  0  0  0
193444  1  0  0  0
194195  1  0  0  0
194445  1  0  0  0
194446  1  0  0  0
195196  1  0  0  0
195447  1  0  0  0
195448  1  0  0  0
196197  1  0  0  0
196449  1  0  0  0
196450  1  0  0  0
197198  2  0  0  0
198200  1  0  0  0
198199  1  0  0  0
199451  1  0  0  0
199452  1  0  0  0
200453  1  0  0  0
200454  1  0  0  0
201203  1  0  0  0
201202  2  0  0  0
203455  1  0  0  0
203456  1  0  0  0
204205  1  0  0  0
204457  1  0  0  0
205207  1  0  0  0
205206  2  0  0  0
207209  1  0  0  0
207208  1  0  0  0
207458  1  0  0  0
208459  1  0  0  0
208460  1  0  0  0
208461  1  0  0  0
209210  1  0  0  0
209462  1  0  0  0
210212  1  0  0  0
210211  2  0  0  0
212217  1  0  0  0
212213  1  0  0  0
212463  1  0  0  0
213214  1  0  0  0
213464  1  0  0  0
213465  1  0  0  0
214216  1  0  0  0
214215  2  0  0  0
216466  1  0  0  0
217218  1  0  0  0
217467  1  0  0  0
218220  1  0  0  0
218219  2  0  0  0
220222  1  0  0  0
220221  1  0  0  0
220468  1  0  0  0
221469  1  0  0  0
221470  1  0  0  0
221471  1  0  0  0
222223  1  0  0  0
222472  1  0  0  0
223225  1  0  0  0
223224  2  0  0  0
225234  1  0  0  0
225226  1  0  0  0
225473  1  0  0  0
226227  1  0  0  0
226474  1  0  0  0
226475  1  0  0  0
227228  2  0  0  0
227232  1  0  0  0
228229  1  0  0  0
228476  1  0  0  0
229230  2  0  0  0
229477  1  0  0  0
230231  1  0  0  0
230233  1  0  0  0
231232  2  0  0  0
231478  1  0  0  0
232479  1  0  0  0
233480  1  0  0  0
234481  1  0  0  0
234482  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL1791238

>  <PubChem CID>
56681649

>  <Formula>
C149H248N44O40S

>  <Molecular Weight>
3327.951000

>  <IUPAC Name>


>  <XlogP>
-9.6

>  <Hydrogen Bond Donors>
48

>  <Hydrogen Bond Acceptors>
47

>  <Canonical SMILES>
CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(C(C)O)C(=O)NC(CC(=O)N)C(=O)NC(CO)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)NC(CCCN=C(N)N)C(=O)NC(CCCCN)C(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NCC(=O)NC(CCC(=O)N)C(=O)NC(CC(C)C)C(=O)NC(CO)C(=O)NC(C)C(=O)NC(CCCN=C(N)N)C(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(CCC(=O)N)C(=O)NC(CC)C(=O)NC(C(C)CC)C(=O)NC(CCSC)C(=O)NC(CO)C(=O)NC(CCCN=C(N)N)C(=O)N)NC(=O)C(C)NC(=O)C(CC(=O)O)NC(=O)C(C)NC(=O)C(CC3=CC=C(C=C3)O)N

>  <Isomeric SMILES>
CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC3=CC=C(C=C3)O)N

>  <InChI Std. ID>
InChI=1S/C149H248N44O40S/c1-21-78(14)116(191-122(209)82(18)168-133(220)106(68-114(204)205)179-121(208)80(16)167-123(210)89(152)64-85-41-45-87(198)46-42-85)145(232)185-104(65-84-34-25-24-26-35-84)139(226)193-118(83(19)197)146(233)186-105(67-112(155)202)138(225)189-109(72-196)142(229)183-103(66-86-43-47-88(199)48-44-86)137(224)176-95(40-33-58-165-149(161)162)127(214)175-93(37-28-30-55-151)132(219)190-115(77(12)13)143(230)184-99(60-73(4)5)124(211)166-69-113(203)170-96(49-51-110(153)200)129(216)181-102(63-76(10)11)136(223)188-107(70-194)140(227)169-81(17)120(207)173-94(39-32-57-164-148(159)160)126(213)174-92(36-27-29-54-150)128(215)180-101(62-75(8)9)135(222)182-100(61-74(6)7)134(221)177-97(50-52-111(154)201)130(217)171-90(23-3)125(212)192-117(79(15)22-2)144(231)178-98(53-59-234-20)131(218)187-108(71-195)141(228)172-91(119(156)206)38-31-56-163-147(157)158/h24-26,34-35,41-48,73-83,89-109,115-118,194-199H,21-23,27-33,36-40,49-72,150-152H2,1-20H3,(H2,153,200)(H2,154,201)(H2,155,202)(H2,156,206)(H,166,211)(H,167,210)(H,168,220)(H,169,227)(H,170,203)(H,171,217)(H,172,228)(H,173,207)(H,174,213)(H,175,214)(H,176,224)(H,177,221)(H,178,231)(H,179,208)(H,180,215)(H,181,216)(H,182,222)(H,183,229)(H,184,230)(H,185,232)(H,186,233)(H,187,218)(H,188,223)(H,189,225)(H,190,219)(H,191,209)(H,192,212)(H,193,226)(H,204,205)(H4,157,158,163)(H4,159,160,164)(H4,161,162,165)/t78-,79-,80-,81-,82-,83+,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,115-,116-,117-,118-/m0/s1

>  <InChI Key>
NBONFYPENOQYOE-LPYSECNISA-N

