
 OpenBabel04291915453D

 43 44  0  0  0  0  0  0  0  0999 V2000
  -13.6000   -1.8819    4.6984 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.6440   -2.1960    5.4825 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4345   -2.6876    6.7145 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.1810   -2.8651    7.1624 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.1370   -2.5511    6.3783 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8096   -1.3903    3.4664 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.4320   -0.9759    2.4317 S   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5851    0.0933    3.1162 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5829   -2.2212    2.1923 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0077   -0.3738    0.9218 N   0  0  0  0  0  0  0  0  0  0  0  0
  -12.1009    0.0207   -0.0642 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5252    0.4645   -1.1769 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5936    0.8697   -2.1897 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.3544    1.3569   -3.4121 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1790    1.8682   -4.6900 S   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0849    2.4484   -6.1456 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1225    2.8670   -7.1920 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5709    3.3359   -8.3678 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5007    3.8014   -9.5313 S   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3255    4.3297  -10.8566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8455    2.7804   -6.9718 N   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6288    4.5156  -11.3227 N   0  0  0  0  0  0  0  0  0  0  0  0
  -12.8263    4.9806  -12.4888 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7401    5.3057  -13.3041 N   0  0  0  0  0  0  0  0  0  0  0  0
  -14.1295    5.1665  -12.9548 N   0  0  0  0  0  0  0  0  0  0  0  0
  -15.9287   -3.1370    7.8368 Br  0  0  0  0  0  0  0  0  0  0  0  0
  -12.6367   -2.0184    5.0426 H   0  0  0  0  0  0  0  0  0  0  0  0
  -15.6073   -2.0595    5.1383 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0200   -3.2429    8.1092 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1256   -2.6263    6.5692 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9758   -0.3081    0.7549 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0861   -0.0481    0.1107 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9776    0.0379   -2.4611 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9792    1.6607   -1.8133 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9704    2.1886   -3.1407 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9688    0.5659   -3.7885 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.7009    3.2801   -5.8743 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6993    1.6573   -6.5220 H   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5856    3.4048   -8.5427 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8214    5.1747  -12.9755 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8931    5.6660  -14.2074 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.8953    4.9372  -12.3801 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.2826    5.5267  -13.8582 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 27  1  0  0  0  0
  2  3  1  0  0  0  0
  2 28  1  0  0  0  0
  3 26  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  4 29  1  0  0  0  0
  5  6  2  0  0  0  0
  5 30  1  0  0  0  0
  6  7  1  0  0  0  0
  7 10  1  0  0  0  0
  7  9  2  0  0  0  0
  7  8  2  0  0  0  0
 10 11  1  0  0  0  0
 10 31  1  0  0  0  0
 11 12  2  3  0  0  0
 11 32  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 33  1  0  0  0  0
 13 34  1  0  0  0  0
 14 15  1  0  0  0  0
 14 35  1  0  0  0  0
 14 36  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 37  1  0  0  0  0
 16 38  1  0  0  0  0
 17 18  2  0  0  0  0
 17 21  1  0  0  0  0
 18 19  1  0  0  0  0
 18 39  1  0  0  0  0
 19 20  1  0  0  0  0
 20 22  1  0  0  0  0
 20 21  2  0  0  0  0
 22 23  2  0  0  0  0
 23 25  1  0  0  0  0
 23 24  1  0  0  0  0
 24 40  1  0  0  0  0
 24 41  1  0  0  0  0
 25 42  1  0  0  0  0
 25 43  1  0  0  0  0
M  END
>  <SKU>
A15075

>  <Product Name>
Ebrotidine

>  <CAS>
100981-43-9

>  <M.Wt>
477.42278

>  <Formula>
C14H17BrN6O2S3

>  <Synonyms>
FI 3542, Ulsanic, FI-3542, FI3542

>  <URL>
https://www.adooq.com/ebrotidine.html

$$$$
