
 OpenBabel04291915473D

 46 47  0  0  0  0  0  0  0  0999 V2000
   13.7565    0.8508   -5.8019 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0148   -0.4165   -6.0023 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4741   -1.3334   -6.8693 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8027   -2.4823   -7.0500 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6719   -2.7142   -6.3637 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0225   -3.8253   -6.5385 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.6863    0.7324   -5.8215 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1794    1.7442   -4.8647 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2953    3.1692   -4.8461 S   0  0  3  0  0  0  0  0  0  0  0  0
   14.3642    3.7797   -6.2431 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6892    4.3791   -3.7020 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3386    5.4902   -3.5272 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.8944    6.3770   -2.6887 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5658    7.5258   -2.5080 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1065    8.4427   -1.6409 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7780    9.5916   -1.4602 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3187   10.5085   -0.5932 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7636    6.1450   -2.0024 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5956    4.1548   -3.0383 N   0  5  0  0  0  0  0  0  0  0  0  0
   14.6100   -1.1004   -7.5587 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0844   -2.0474   -8.4542 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3680   -1.5426   -9.0928 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8879   -2.5804  -10.0742 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0871   -2.1088  -10.6708 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.5728   -3.0783  -11.5876 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9780    0.0964    0.0151 Na  0  3  0  0  0 15  0  0  0  0  0  0
   14.4707    0.7255   -5.0151 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0697    1.6283   -5.5397 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.2644    1.1136   -6.7062 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1556   -3.1869   -7.7163 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3189   -2.0096   -5.6975 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1311    1.3162   -3.8852 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.2021    2.0604   -5.1644 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.4348    7.7041   -3.0354 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.2376    8.2645   -1.1135 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.6470    9.7699   -1.9876 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.3070   11.3968   -0.0679 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.3510   -2.2183   -9.2144 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2801   -2.9625   -7.9353 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.1014   -1.3717   -8.3326 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.1724   -0.6275   -9.6117 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.1546   -2.7513  -10.8344 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.0836   -3.4955   -9.5552 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.4764   -2.7230  -12.0371 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.8394   -3.2492  -12.3478 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.7684   -3.9934  -11.0686 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 27  1  0  0  0  0
  1 28  1  0  0  0  0
  1 29  1  0  0  0  0
  2  3  2  0  0  0  0
  2  7  1  0  0  0  0
  3 20  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4 30  1  0  0  0  0
  5  6  1  0  0  0  0
  5 31  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 32  1  0  0  0  0
  8 33  1  0  0  0  0
  9 11  1  0  0  0  0
  9 10  2  0  0  0  0
 11 12  2  0  0  0  0
 11 19  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 18  1  0  0  0  0
 14 15  1  0  0  0  0
 14 34  1  0  0  0  0
 15 16  2  0  0  0  0
 15 35  1  0  0  0  0
 16 17  1  0  0  0  0
 16 36  1  0  0  0  0
 17 18  2  0  0  0  0
 17 37  1  0  0  0  0
 18 19  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 38  1  0  0  0  0
 21 39  1  0  0  0  0
 22 23  1  0  0  0  0
 22 40  1  0  0  0  0
 22 41  1  0  0  0  0
 23 24  1  0  0  0  0
 23 42  1  0  0  0  0
 23 43  1  0  0  0  0
 24 25  1  0  0  0  0
 25 44  1  0  0  0  0
 25 45  1  0  0  0  0
 25 46  1  0  0  0  0
M  CHG  2  19  -1  26   1
M  END
>  <SKU>
A16147

>  <Product Name>
Rebeprazole sodium

>  <CAS>
117976-90-6

>  <M.Wt>
381.42447

>  <Formula>
C18H20N3NaO3S

>  <Synonyms>
Aciphex sodium, LY307640 sodium

>  <URL>
https://www.adooq.com/rebeprazole-sodium.html

$$$$
