
 OpenBabel04291915453D

 53 57  0  0  1  0  0  0  0  0999 V2000
   -6.6311    1.2743   -1.1630 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3661    0.3787   -0.2582 N   0  3  3  0  0  0  0  0  0  0  0  0
   -6.4109   -0.4083    0.5350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5381   -1.2337   -0.3962 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5503   -2.0475    0.4239 C   0  0  3  0  0  0  0  0  0  0  0  0
   -3.6775   -2.8729   -0.5073 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.7144   -3.6663    0.2923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7188   -3.5838    1.5171 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7461   -4.5594   -0.3867 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8803   -5.2520    0.6531 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3103   -2.9735    1.3594 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.6057   -1.9168   -1.4798 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.1113   -2.1114   -1.2816 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3703   -1.2077   -2.1929 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0014   -1.2045   -2.1897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6585   -1.2053   -2.1905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9870   -0.3871   -3.0171 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6441   -0.3879   -3.0179 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9727   -1.2069   -2.1921 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.9840   -2.0279   -1.3610 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1257   -2.2023    2.2294 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2103    1.1770    0.6424 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9703    0.2510    1.5779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8431    1.0765    2.5091 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9825   -0.5627    2.3981 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9784    0.0258    0.0942 Br  0  5  0  0  0  0  0  0  0  0  0  0
   -7.2949    2.0246   -1.5389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2334    0.7085   -1.9794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8302    1.7416   -0.6292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9459   -1.0601    1.1935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7950    0.2519    1.1092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0031   -0.5819   -1.0548 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1540   -1.8939   -0.9705 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2934   -3.5331   -1.0816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1258   -3.9820   -1.0400 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2767   -5.2940   -0.9556 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0314   -4.8110    0.9984 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4440   -6.2156    0.8143 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6543   -1.9059   -1.6921 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8520   -3.1268   -1.4978 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8535   -1.8856   -0.2680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1281    0.2408   -3.6531 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4887   -1.8356   -1.5569 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5985    0.4361   -3.8461 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9884   -2.6339    2.3311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9056    1.7498    0.0651 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5944    1.8372    1.2167 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5862   -0.4092    1.0037 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8476    0.8105    2.7644 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1073    2.0727    2.7965 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9535   -0.2943    2.5163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6822   -1.5553    2.6618 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 28  1  0  0  0  0
  1 29  1  0  0  0  0
  1 30  1  0  0  0  0
  2 23  1  0  0  0  0
  2  3  1  0  0  0  0
  2 12  1  0  0  0  0
  3  4  1  0  0  0  0
  3 31  1  0  0  0  0
  3 32  1  0  0  0  0
  4  5  1  0  0  0  0
  4 33  1  0  0  0  0
  4 34  1  0  0  0  0
  5  6  1  0  0  0  0
  5 11  1  0  0  0  0
  5 15  1  0  0  0  0
  6  7  1  0  0  0  0
  6 21  1  0  0  0  0
  6 35  1  0  0  0  0
  7  9  1  0  0  0  0
  7  8  2  0  0  0  0
  9 10  1  0  0  0  0
  9 36  1  0  0  0  0
  9 37  1  0  0  0  0
 10 11  1  0  0  0  0
 10 38  1  0  0  0  0
 10 39  1  0  0  0  0
 11 22  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 40  1  0  0  0  0
 13 14  1  0  0  0  0
 13 41  1  0  0  0  0
 13 42  1  0  0  0  0
 14 19  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 21  1  0  0  0  0
 16 17  2  0  0  0  0
 17 20  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 43  1  0  0  0  0
 19 44  1  0  0  0  0
 20 45  1  0  0  0  0
 22 46  1  0  0  0  0
 23 24  1  0  0  0  0
 23 47  1  0  0  0  0
 23 48  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 24 49  1  0  0  0  0
 25 26  1  0  0  0  0
 25 50  1  0  0  0  0
 25 51  1  0  0  0  0
 26 52  1  0  0  0  0
 26 53  1  0  0  0  0
M  CHG  2   2   1  27  -1
M  END
>  <SKU>
A15159

>  <Product Name>
Methylnaltrexone Bromide

>  <CAS>
73232-52-7

>  <M.Wt>
436.33944

>  <Formula>
C21H26BrNO4

>  <Synonyms>
N/A

>  <URL>
https://www.adooq.com/methylnaltrexone-bromide.html

$$$$
