
 NPY, zebrafish

592601  0  0  0  0  0  0  0  0999 V2000
   23.3901   21.4696  -24.4645 C   0  0  0  0  0
   24.4175   20.9489  -23.4673 C   0  0  0  0  0
   24.0549   21.2172  -21.9836 C   0  0  0  0  0
   22.7352   20.5246  -21.6219 C   0  0  0  0  0
   25.2417   20.7945  -21.0554 C   0  0  0  0  0
   26.4338   21.7583  -21.2767 C   0  0  0  0  0
   27.3497   21.4343  -22.0460 O   0  0  0  0  0
   26.5030   23.0428  -20.8345 N   0  0  0  0  0
   25.9360   23.7889  -19.6961 C   0  0  0  0  0
   24.4180   23.8894  -19.6507 C   0  0  0  0  0
   23.9069   24.5120  -18.3749 C   0  0  0  0  0
   23.1959   23.8975  -17.5872 O   0  0  0  0  0
   24.2314   25.8111  -18.1470 N   0  0  0  0  0
   26.5826   23.2285  -18.4191 C   0  0  0  0  0
   26.0957   22.2386  -17.8645 O   0  0  0  0  0
   27.7829   23.6729  -17.9513 N   0  0  0  0  0
   28.5867   24.8847  -18.2274 C   0  0  0  0  0
   28.9650   25.0399  -19.7123 C   0  0  0  0  0
   30.2278   25.8838  -19.9777 C   0  0  0  0  0
   31.5074   25.1188  -19.6316 C   0  0  0  0  0
   30.2797   26.3044  -21.4508 C   0  0  0  0  0
   27.7632   26.0555  -17.6538 C   0  0  0  0  0
   26.8953   26.6261  -18.3241 O   0  0  0  0  0
   27.7995   26.3518  -16.3117 N   0  0  0  0  0
   29.0059   26.7884  -15.5747 C   0  0  0  0  0
   29.5363   25.7838  -14.5124 C   0  0  0  0  0
   29.9839   24.4284  -15.0507 C   0  0  0  0  0
   30.6479   26.4472  -13.6620 C   0  0  0  0  0
   31.0634   25.6425  -12.4373 C   0  0  0  0  0
   30.0375   27.3999  -16.5405 C   0  0  0  0  0
   31.0065   26.7527  -16.9421 O   0  0  0  0  0
   29.8167   28.6114  -17.1384 N   0  0  0  0  0
   29.2131   29.8431  -16.5726 C   0  0  0  0  0
   27.6791   29.8194  -16.4085 C   0  0  0  0  0
   27.1325   31.1932  -16.0234 C   0  0  0  0  0
   27.0468   29.4684  -17.6458 O   0  0  0  0  0
   29.9527   30.1497  -15.2620 C   0  0  0  0  0
   29.4851   29.7810  -14.1798 O   0  0  0  0  0
   31.2112   30.6714  -15.2431 N   0  0  0  0  0
   31.9401   31.5102  -16.2139 C   0  0  0  0  0
   32.1547   30.8650  -17.5870 C   0  0  0  0  0
   33.3215   31.4957  -18.3559 C   0  0  0  0  0
   33.4311   30.8938  -19.7567 C   0  0  0  0  0
   34.6083   31.4297  -20.4275 N   0  0  0  0  0
   35.6733   30.7305  -20.5126 C   0  0  0  0  0
   35.9598   29.5008  -20.0312 N   0  0  0  0  0
   36.7405   31.2178  -21.1818 N   0  0  0  0  0
   31.2046   32.8611  -16.2773 C   0  0  0  0  0
   30.2443   33.0202  -17.0393 O   0  0  0  0  0
   31.4625   33.8687  -15.3990 N   0  0  0  0  0
   32.5541   34.1079  -14.4400 C   0  0  0  0  0
   32.7470   32.9984  -13.4036 C   0  0  0  0  0
   33.6403   33.4253  -12.2365 C   0  0  0  0  0
   33.9524   32.2404  -11.3498 C   0  0  0  0  0
   33.3187   31.1922  -11.3510 O   0  0  0  0  0
   35.0068   32.4217  -10.5063 N   0  0  0  0  0
   33.8356   34.4034  -15.2392 C   0  0  0  0  0
   34.5436   33.4857  -15.6664 O   0  0  0  0  0
   34.1874   35.6649  -15.6073 N   0  0  0  0  0
   33.7020   36.9922  -15.2023 C   0  0  0  0  0
   32.2160   37.2423  -15.4967 C   0  0  0  0  0
   31.9038   38.7430  -15.5173 C   0  0  0  0  0
   30.4589   39.0269  -15.9201 C   0  0  0  0  0
   30.1991   40.4593  -15.8093 N   0  0  0  0  0
   30.4443   41.2331  -16.7944 C   0  0  0  0  0
   30.9586   40.9647  -18.0141 N   0  0  0  0  0
   30.1810   42.5542  -16.6910 N   0  0  0  0  0
   34.0870   37.2211  -13.7303 C   0  0  0  0  0
   33.3996   36.7639  -12.8099 O   0  0  0  0  0
   35.2660   37.7973  -13.3684 N   0  0  0  0  0
   36.3109   38.5142  -14.1189 C   0  0  0  0  0
   36.9577   37.7211  -15.2625 C   0  0  0  0  0
   38.2588   38.3344  -15.7281 C   0  0  0  0  0
   39.4720   37.9798  -15.1200 C   0  0  0  0  0
   40.6699   38.5665  -15.5368 C   0  0  0  0  0
   40.6517   39.5107  -16.5575 C   0  0  0  0  0
   39.4595   39.8738  -17.1694 C   0  0  0  0  0
   38.2634   39.2867  -16.7576 C   0  0  0  0  0
   41.7950   40.1100  -16.9935 O   0  0  0  0  0
   35.7756   39.8649  -14.5871 C   0  0  0  0  0
   34.9572   40.0470  -15.4743 O   0  0  0  0  0
   36.2261   40.8958  -13.8458 O   0  0  0  0  0
   24.8737   20.6412  -19.6475 N   0  0  0  0  0
   24.5065   19.4304  -19.1038 C   0  0  0  0  0
   24.4508   18.3867  -19.7533 O   0  0  0  0  0
   24.0406   19.4962  -17.6268 C   0  0  0  0  0
   22.5681   19.9390  -17.6549 C   0  0  0  0  0
   21.9302   20.0533  -16.2952 C   0  0  0  0  0
   22.1344   21.1928  -15.5043 C   0  0  0  0  0
   21.5656   21.2798  -14.2334 C   0  0  0  0  0
   20.7961   20.2291  -13.7525 C   0  0  0  0  0
   20.5618   19.1011  -14.5318 C   0  0  0  0  0
   21.1303   19.0128  -15.8025 C   0  0  0  0  0
   20.2987   20.3223  -12.4870 O   0  0  0  0  0
   24.2265   18.1457  -17.0762 N   0  0  0  0  0
   25.0189   17.6834  -16.0736 C   0  0  0  0  0
   25.3604   16.4952  -16.1538 O   0  0  0  0  0
   25.3371   18.4641  -14.7751 C   0  0  0  0  0
   25.8996   19.8735  -14.9585 C   0  0  0  0  0
   26.6870   20.3246  -13.7731 C   0  0  0  0  0
   27.9766   19.9984  -13.4088 C   0  0  0  0  0
   28.1807   20.6294  -12.2119 N   0  0  0  0  0
   27.0463   21.3291  -11.9172 C   0  0  0  0  0
   26.1298   21.1695  -12.8427 N   0  0  0  0  0
   24.1411   18.4269  -13.9259 N   0  0  0  0  0
   23.7715   17.5467  -12.9578 C   0  0  0  0  0
   22.5669   17.4560  -12.6896 O   0  0  0  0  0
   24.7710   16.6175  -12.2308 C   0  0  0  0  0
   25.1881   15.4519  -13.1385 C   0  0  0  0  0
   25.5352   14.1923  -12.3413 C   0  0  0  0  0
   26.0417   13.0857  -13.2651 C   0  0  0  0  0
   26.2579   11.8674  -12.4935 N   0  0  0  0  0
   25.3299   10.9953  -12.3982 C   0  0  0  0  0
   24.0758   10.9811  -12.9003 N   0  0  0  0  0
   25.5413    9.8745  -11.6749 N   0  0  0  0  0
   25.9409   17.3121  -11.6879 N   0  0  0  0  0
   26.1517   17.9345  -10.4974 C   0  0  0  0  0
   27.2791   18.4094  -10.3055 O   0  0  0  0  0
   25.0957   18.0000   -9.3673 C   0  0  0  0  0
   23.7656   18.6269   -9.8054 C   0  0  0  0  0
   22.9776   19.2961   -8.6578 C   0  0  0  0  0
   23.6492   20.5790   -8.1608 C   0  0  0  0  0
   21.5582   19.6239   -9.1307 C   0  0  0  0  0
   24.9048   16.6826   -8.7578 N   0  0  0  0  0
   25.5084   16.0915   -7.6921 C   0  0  0  0  0
   25.2481   14.9002   -7.4855 O   0  0  0  0  0
   26.3840   16.8577   -6.6805 C   0  0  0  0  0
   27.5995   17.5673   -7.2512 C   0  0  0  0  0
   25.5453   17.7496   -5.8806 N   0  0  0  0  0
   25.0930   17.6314   -4.6008 C   0  0  0  0  0
   24.1222   18.3237   -4.2800 O   0  0  0  0  0
   25.7421   16.6932   -3.5654 C   0  0  0  0  0
   25.3924   15.2236   -3.8095 C   0  0  0  0  0
   25.6358   14.4691   -2.6194 O   0  0  0  0  0
   27.1900   16.9327   -3.4876 N   0  0  0  0  0
   27.8630   17.8221   -2.7053 C   0  0  0  0  0
   28.9936   18.1550   -3.0783 O   0  0  0  0  0
   27.3133   18.3537   -1.3700 C   0  0  0  0  0
   26.1687   19.3642   -1.5539 C   0  0  0  0  0
   25.9984   20.2552   -0.3404 C   0  0  0  0  0
   26.9657   21.2245   -0.0293 C   0  0  0  0  0
   26.8185   22.0333    1.0976 C   0  0  0  0  0
   25.7027   21.8866    1.9097 C   0  0  0  0  0
   24.7291   20.9381    1.6161 C   0  0  0  0  0
   24.8781   20.1222    0.4918 C   0  0  0  0  0
   25.5962   22.6997    2.9985 O   0  0  0  0  0
   26.9887   17.2418   -0.4664 N   0  0  0  0  0
   27.8048   16.4980    0.3355 C   0  0  0  0  0
   27.2692   15.6725    1.0890 O   0  0  0  0  0
   29.3475   16.5170    0.2304 C   0  0  0  0  0
   29.7961   15.5731   -0.9011 C   0  0  0  0  0
   31.2773   15.2794   -0.8360 C   0  0  0  0  0
   31.7596   14.2834    0.0229 C   0  0  0  0  0
   33.1291   14.0446    0.1230 C   0  0  0  0  0
   34.0192   14.8035   -0.6260 C   0  0  0  0  0
   33.5609   15.7939   -1.4873 C   0  0  0  0  0
   32.1887   16.0298   -1.5934 C   0  0  0  0  0
   35.3505   14.5481   -0.4819 O   0  0  0  0  0
   29.9546   17.8456    0.1192 N   0  0  0  0  0
   30.3380   18.7567    1.0560 C   0  0  0  0  0
   30.6991   19.8606    0.6310 O   0  0  0  0  0
   30.2081   18.5338    2.5856 C   0  0  0  0  0
   28.7877   18.9429    3.0141 C   0  0  0  0  0
   28.6356   19.0227    4.5364 C   0  0  0  0  0
   27.1946   19.3413    4.9400 C   0  0  0  0  0
   27.0509   19.3842    6.4612 C   0  0  0  0  0
   25.6783   19.6808    6.8511 N   0  0  0  0  0
   30.4904   17.1694    3.0039 N   0  0  0  0  0
   31.6414   16.4644    3.0857 C   0  0  0  0  0
   31.5062   15.2475    3.2682 O   0  0  0  0  0
   33.0531   17.0680    3.1588 C   0  0  0  0  0
   33.3850   18.2016    2.2077 C   0  0  0  0  0
   33.3356   17.4216    4.5518 N   0  0  0  0  0
   33.7361   16.6022    5.5707 C   0  0  0  0  0
   33.7958   17.0742    6.7092 O   0  0  0  0  0
   34.1243   15.1292    5.2964 C   0  0  0  0  0
   35.5766   15.1264    4.7742 C   0  0  0  0  0
   36.1303   13.7522    4.3459 C   0  0  0  0  0
   35.3180   13.1260    3.2154 C   0  0  0  0  0
   37.5908   13.9018    3.9080 C   0  0  0  0  0
   34.0176   14.3116    6.5188 N   0  0  0  0  0
   32.9143   13.8954    7.2042 C   0  0  0  0  0
   33.0628   12.9766    8.0141 O   0  0  0  0  0
   31.5468   14.5881    7.0198 C   0  0  0  0  0
   30.7007   13.8816    5.9525 C   0  0  0  0  0
   29.4635   14.7147    5.5992 C   0  0  0  0  0
   28.7902   14.2613    4.3283 C   0  0  0  0  0
   28.6085   13.1116    3.9695 O   0  0  0  0  0
   28.3216   15.3103    3.6112 O   0  0  0  0  0
   30.8293   14.5641    8.3056 N   0  0  0  0  0
   31.0215   15.3400    9.4112 C   0  0  0  0  0
   30.4789   14.9866   10.4613 O   0  0  0  0  0
   31.8996   16.6108    9.3354 C   0  0  0  0  0
   31.1675   17.7333    8.5846 C   0  0  0  0  0
   32.0147   19.0003    8.4554 C   0  0  0  0  0
   31.6556   19.7710    7.2126 C   0  0  0  0  0
   31.7797   19.3907    6.0561 O   0  0  0  0  0
   31.1412   20.9832    7.4898 O   0  0  0  0  0
   32.2304   17.0408   10.7021 N   0  0  0  0  0
   33.1510   16.4902   11.5529 C   0  0  0  0  0
   33.0922   16.7932   12.7455 O   0  0  0  0  0
   34.2262   15.5277   11.0023 C   0  0  0  0  0
   35.2983   16.3141   10.2528 C   0  0  0  0  0
   34.8608   14.7575   12.0822 N   0  0  0  0  0
   34.3596   13.6977   12.7902 C   0  0  0  0  0
   35.0390   13.2315   13.7083 O   0  0  0  0  0
   32.9708   13.1360   12.4151 C   0  0  0  0  0
   33.0508   12.3235   11.1167 C   0  0  0  0  0
   33.1772   10.8819   11.5909 C   0  0  0  0  0
   32.2855   10.8578   12.8142 C   0  0  0  0  0
   32.4337   12.1784   13.3945 N   0  0  0  0  0
   31.8698   12.4586   14.6185 C   0  0  0  0  0
   31.2708   11.5808   15.2539 O   0  0  0  0  0
   32.1890   13.8038   15.2988 C   0  0  0  0  0
   30.9226   14.4532   15.8370 C   0  0  0  0  0
   33.0839   13.4200   16.3924 N   0  0  0  0  0
   34.0356   14.2513   16.9241 C   0  0  0  0  0
   34.1436   15.4386   16.6326 O   0  0  0  0  0
   34.9943   13.5470   17.9034 C   0  0  0  0  0
   36.0200   12.7434   17.1003 C   0  0  0  0  0
   36.6900   11.7424   17.9918 C   0  0  0  0  0
   36.4766   11.5684   19.1802 O   0  0  0  0  0
   37.6029   10.9972   17.3385 O   0  0  0  0  0
   35.6519   14.5515   18.7458 N   0  0  0  0  0
   35.3627   14.9627   20.0091 C   0  0  0  0  0
   35.8686   16.0192   20.4013 O   0  0  0  0  0
   34.3667   14.2123   20.9211 C   0  0  0  0  0
   32.9101   14.3979   20.4679 C   0  0  0  0  0
   32.5258   15.8699   20.2883 C   0  0  0  0  0
   31.0546   16.0769   20.0471 C   0  0  0  0  0
   30.4256   17.0820   20.3339 O   0  0  0  0  0
   30.4571   15.0623   19.3992 O   0  0  0  0  0
   34.7178   12.7987   21.1037 N   0  0  0  0  0
   34.4102   11.9757   22.1514 C   0  0  0  0  0
   34.8892   10.8408   22.1923 O   0  0  0  0  0
   33.4205   12.4501   23.2236 C   0  0  0  0  0
   33.6486   11.7413   24.4771 N   0  0  0  0  0
   34.0518   12.1880   25.6975 C   0  0  0  0  0
   34.3488   11.3421   26.5471 O   0  0  0  0  0
   34.1887   13.6820   26.0413 C   0  0  0  0  0
   35.4168   14.2821   25.3442 C   0  0  0  0  0
   35.0506   15.7487   25.1830 C   0  0  0  0  0
   33.5567   15.7136   24.9099 C   0  0  0  0  0
   33.0707   14.5376   25.6259 N   0  0  0  0  0
   31.7598   14.5274   26.0474 C   0  0  0  0  0
   30.9224   15.1926   25.4247 O   0  0  0  0  0
   31.2710   13.6547   27.2328 C   0  0  0  0  0
   30.9056   12.2520   26.7395 C   0  0  0  0  0
   29.6858   11.7109   27.4551 C   0  0  0  0  0
   29.0724   12.3097   28.3267 O   0  0  0  0  0
   29.3139   10.4619   27.0587 N   0  0  0  0  0
   32.1789   13.6113   28.3856 N   0  0  0  0  0
   32.2760   14.4251   29.4741 C   0  0  0  0  0
   32.9968   14.0296   30.3986 O   0  0  0  0  0
   31.4860   15.7409   29.6507 C   0  0  0  0  0
   31.4067   16.6119   28.4037 C   0  0  0  0  0
   31.4428   18.0688   28.7487 C   0  0  0  0  0
   30.5174   18.7363   29.1751 O   0  0  0  0  0
   32.6588   18.6176   28.5680 O   0  0  0  0  0
   30.1713   15.5014   30.2572 N   0  0  0  0  0
   29.7665   15.5912   31.5633 C   0  0  0  0  0
   28.5934   15.3014   31.8139 O   0  0  0  0  0
   30.7663   15.9700   32.6857 C   0  0  0  0  0
   31.3130   17.4011   32.5144 C   0  0  0  0  0
   30.5532   18.2342   33.5295 C   0  0  0  0  0
   30.4047   17.2755   34.6862 C   0  0  0  0  0
   30.2071   15.9750   34.0625 N   0  0  0  0  0
   29.8150   14.9336   34.8856 C   0  0  0  0  0
   29.7247   15.1327   36.1055 O   0  0  0  0  0
   29.3472   13.5717   34.3038 C   0  0  0  0  0
   30.4270   12.7738   33.5491 C   0  0  0  0  0
   29.8718   11.4418   33.0140 C   0  0  0  0  0
   30.8901   10.6718   32.1745 C   0  0  0  0  0
   30.3494    9.2784   31.8470 C   0  0  0  0  0
   31.3008    8.5322   31.0330 N   0  0  0  0  0
   28.8150   12.7142   35.3896 N   0  0  0  0  0
   27.5827   12.6378   35.9521 C   0  0  0  0  0
   27.2566   11.5431   36.4320 O   0  0  0  0  0
   26.5955   13.8257   36.0142 C   0  0  0  0  0
   26.0297   14.2488   34.6465 C   0  0  0  0  0
   25.5290   13.0931   33.7884 C   0  0  0  0  0
   24.9283   15.1487   34.8438 O   0  0  0  0  0
   25.4599   13.4335   36.9228 N   0  0  0  0  0
   25.6282   13.7156   38.2668 C   0  0  0  0  0
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M  END

>  <Chemical Name>
NPY, zebrafish

>  <PubChem CID>
57340160

>  <Formula>
C192H290N52O58

>  <Molecular Weight>
4254.738000

>  <IUPAC Name>


>  <XlogP>
-16.9

>  <Hydrogen Bond Donors>
58

>  <Hydrogen Bond Acceptors>
65

>  <Canonical SMILES>
CCC(C)C(C(=O)NC(CC(=O)N)C(=O)NC(CC(C)C)C(=O)NC(C(C)CC)C(=O)NC(C(C)O)C(=O)NC(CCCN=C(N)N)C(=O)NC(CCC(=O)N)C(=O)NC(CCCN=C(N)N)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)O)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CC3=CNC=N3)NC(=O)C(CCCN=C(N)N)NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(CO)NC(=O)C(CC4=CC=C(C=C4)O)NC(=O)C(CC5=CC=C(C=C5)O)NC(=O)C(CCCCN)NC(=O)C(C)NC(=O)C(CC(C)C)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(C)NC(=O)C6CCCN6C(=O)C(C)NC(=O)C(CC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)CNC(=O)C7CCCN7C(=O)C(CC(=O)N)NC(=O)C(CC(=O)O)NC(=O)C8CCCN8C(=O)C(CCCCN)NC(=O)C(C(C)O)NC(=O)C9CCCN9C(=O)C(CC1=CC=C(C=C1)O)N

>  <Isomeric SMILES>
CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CC3=CNC=N3)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CC5=CC=C(C=C5)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]6CCCN6C(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H]7CCCN7C(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]8CCCN8C(=O)[C@H](CCCCN)NC(=O)[C@H](C(C)O)NC(=O)[C@@H]9CCCN9C(=O)[C@H](CC1=CC=C(C=C1)O)N

>  <InChI Std. ID>
InChI=1S/C192H290N52O58/c1-17-96(9)151(181(293)233-132(85-143(197)254)172(284)226-127(78-95(7)8)174(286)238-152(97(10)18-2)182(294)240-154(103(16)247)183(295)222-119(34-25-71-208-192(203)204)158(270)220-121(59-63-142(196)253)163(275)218-118(33-24-70-207-191(201)202)161(273)235-136(189(301)302)83-108-47-57-114(252)58-48-108)237-175(287)130(82-107-45-55-113(251)56-46-107)229-171(283)131(84-109-89-205-92-210-109)230-160(272)117(32-23-69-206-190(199)200)219-168(280)126(77-94(5)6)224-157(269)99(12)212-176(288)137(91-245)236-170(282)129(81-106-43-53-112(250)54-44-106)228-169(281)128(80-105-41-51-111(249)52-42-105)227-159(271)116(30-19-21-67-193)216-155(267)98(11)211-166(278)125(76-93(3)4)225-165(277)123(62-66-148(261)262)221-164(276)122(61-65-147(259)260)217-156(268)100(13)213-178(290)139-36-27-72-241(139)185(297)101(14)214-167(279)133(87-149(263)264)231-162(274)120(60-64-146(257)258)215-145(256)90-209-177(289)138-35-26-74-243(138)188(300)135(86-144(198)255)234-173(285)134(88-150(265)266)232-179(291)140-37-29-75-244(140)187(299)124(31-20-22-68-194)223-184(296)153(102(15)246)239-180(292)141-38-28-73-242(141)186(298)115(195)79-104-39-49-110(248)50-40-104/h39-58,89,92-103,115-141,151-154,245-252H,17-38,59-88,90-91,193-195H2,1-16H3,(H2,196,253)(H2,197,254)(H2,198,255)(H,205,210)(H,209,289)(H,211,278)(H,212,288)(H,213,290)(H,214,279)(H,215,256)(H,216,267)(H,217,268)(H,218,275)(H,219,280)(H,220,270)(H,221,276)(H,222,295)(H,223,296)(H,224,269)(H,225,277)(H,226,284)(H,227,271)(H,228,281)(H,229,283)(H,230,272)(H,231,274)(H,232,291)(H,233,293)(H,234,285)(H,235,273)(H,236,282)(H,237,287)(H,238,286)(H,239,292)(H,240,294)(H,257,258)(H,259,260)(H,261,262)(H,263,264)(H,265,266)(H,301,302)(H4,199,200,206)(H4,201,202,207)(H4,203,204,208)/t96-,97-,98-,99-,100-,101-,102?,103+,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,151-,152-,153-,154-/m0/s1

>  <InChI Key>
JOHLMVOWAZKKIB-JKQYVYSSSA-N

