
 OpenBabel04291915373D

 52 53  0  0  0  0  0  0  0  0999 V2000
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    6.4756   -4.5617    3.3230 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3230   -3.8090    2.7742 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0697   -4.1996    3.0575 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0596   -3.5400    2.5766 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2614   -2.5026    1.8217 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5317   -2.7363    1.9937 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6090   -2.0826    1.5172 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8177   -1.0099    0.7366 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0710   -0.6193    0.4534 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2797    0.4534   -0.3272 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5330    0.8441   -0.6104 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6535   -2.7646    2.0144 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4527   -3.7966    2.7653 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.4502   -4.0416    2.9404 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1424   -2.5466    1.8485 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0151   -1.7216    1.2474 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7464   -1.9292    1.4024 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9710    0.0773   -0.0564 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3140    0.9964   -0.7274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1300    0.9964   -0.7274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7438    0.1378   -0.1006 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8045    1.9400   -1.4162 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4150    0.0773   -0.0564 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0288   -0.7814    0.5704 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0895    1.0209   -0.7453 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7827   -4.2317    3.0855 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8321   -5.6978    3.0712 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8310   -4.6696    4.4840 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7662   -3.9535    1.8514 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4354   -4.5460    4.3921 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4366   -5.5742    2.9793 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9093   -5.0239    3.6573 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3571   -2.2351    1.6296 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0151   -0.4857    0.3545 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8737   -1.1434    0.8355 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4770    0.9776   -0.7093 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2739    1.4251   -1.0327 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3656   -3.9388    2.8633 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4864   -3.3334    2.4209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9403   -1.3524    0.9779 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6049   -1.4658    1.0658 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4550   -0.6446    0.4705 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8300    1.7183   -1.2544 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7415    1.9400   -1.4162 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0265    1.0209   -0.7453 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 33  1  0  0  0  0
  1 34  1  0  0  0  0
  1 35  1  0  0  0  0
  2  3  1  0  0  0  0
  2 36  1  0  0  0  0
  3  4  1  0  0  0  0
  3 37  1  0  0  0  0
  3 38  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  5  6  1  0  0  0  0
  5 39  1  0  0  0  0
  6 16  1  0  0  0  0
  6  7  1  0  0  0  0
  7  9  1  0  0  0  0
  7  8  2  0  0  0  0
  8 40  1  0  0  0  0
  9 10  2  0  0  0  0
  9 14  1  0  0  0  0
 10 11  1  0  0  0  0
 10 41  1  0  0  0  0
 11 12  2  0  0  0  0
 11 42  1  0  0  0  0
 12 13  1  0  0  0  0
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 14 15  1  0  0  0  0
 16 19  1  0  0  0  0
 16 18  2  0  0  0  0
 16 17  2  0  0  0  0
 19 20  2  0  0  0  0
 19 24  1  0  0  0  0
 20 21  1  0  0  0  0
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 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
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 23 24  2  0  0  0  0
 23 47  1  0  0  0  0
 24 48  1  0  0  0  0
 25 30  1  0  0  0  0
 25 26  2  0  0  0  0
 25 49  1  0  0  0  0
 26 27  1  0  0  0  0
 26 50  1  0  0  0  0
 27 29  1  0  0  0  0
 27 28  2  0  0  0  0
 29 51  1  0  0  0  0
 30 32  1  0  0  0  0
 30 31  2  0  0  0  0
 32 52  1  0  0  0  0
M  END
>  <SKU>
A11239

>  <Product Name>
TAK-438 (vonoprazan)

>  <CAS>
1260141-27-2

>  <M.Wt>
461.4634032

>  <Formula>
C21H20FN3O6S

>  <Synonyms>
TAK438

>  <URL>
https://www.adooq.com/tak-438.html

$$$$
