
 OpenBabel04291915453D

 52 55  0  0  0  0  0  0  0  0999 V2000
    7.2343    2.4410   -2.7911 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4933    1.5961   -1.8249 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1504    1.5970   -1.8242 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4789    0.8314   -0.9488 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1504    0.0649   -0.0741 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4933    0.0640   -0.0748 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1647   -0.7024    0.7999 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4933   -1.4680    1.6754 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1504   -1.4672    1.6761 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4789   -0.7007    0.8014 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1427    0.8549   -0.9790 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9367   -0.7035    0.7989 S   0  0  0  0  0  0  0  0  0  0  0  0
    9.4444   -1.1676   -0.5634 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4465    0.7075    1.0781 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5234   -1.7969    2.0471 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9934   -1.7978    2.0463 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5001   -2.7421    3.1243 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9201   -2.7430    3.1235 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3934   -3.6251    4.1306 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0324   -3.1561    1.7782 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0349    0.8323   -0.9480 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4211    1.5329   -1.7475 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3367    0.0361   -0.0376 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4284    2.4211   -2.7647 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0422    3.1210   -3.5650 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9022    0.0370   -0.0368 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3955   -0.9066    1.0418 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9915   -0.9057    1.0425 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6660   -1.6748    1.9219 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0522   -2.3755    2.7215 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1480   -1.6739    1.9228 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5390    2.9772   -3.4026 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8487    1.8206   -3.4095 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8502    3.1353   -2.2586 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0093    0.6524   -0.7476 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0093   -2.0571    2.3475 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6344   -2.0556    2.3488 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3508   -0.8084    2.2421 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3493   -2.1231    1.0912 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1427   -3.7314    2.9286 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1441   -2.4167    4.0795 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.5281   -3.3089    5.1439 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.1662   -4.3460    4.2981 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9823   -3.4730    0.7575 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0854   -3.5910    2.0211 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5448   -0.2879   -0.9916 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5462    1.0268    0.1593 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7529   -0.5817    1.9965 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7514   -1.8964    0.8456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5047   -1.0092    1.1639 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5039   -1.3485    2.8779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5054   -2.6633    1.7270 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 32  1  0  0  0  0
  1 33  1  0  0  0  0
  1 34  1  0  0  0  0
  2  3  2  0  0  0  0
  2 11  1  0  0  0  0
  3  4  1  0  0  0  0
  3 24  1  0  0  0  0
  4 21  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  5 10  1  0  0  0  0
  6  7  2  0  0  0  0
  6 35  1  0  0  0  0
  7 12  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 36  1  0  0  0  0
  9 10  1  0  0  0  0
  9 37  1  0  0  0  0
 10 11  2  0  0  0  0
 12 15  1  0  0  0  0
 12 14  2  0  0  0  0
 12 13  2  0  0  0  0
 15 16  1  0  0  0  0
 15 20  1  0  0  0  0
 16 17  1  0  0  0  0
 16 38  1  0  0  0  0
 16 39  1  0  0  0  0
 17 18  1  0  0  0  0
 17 40  1  0  0  0  0
 17 41  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 42  1  0  0  0  0
 19 43  1  0  0  0  0
 20 44  1  0  0  0  0
 20 45  1  0  0  0  0
 21 23  1  0  0  0  0
 21 22  2  0  0  0  0
 23 26  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 26 27  1  0  0  0  0
 26 46  1  0  0  0  0
 26 47  1  0  0  0  0
 27 28  1  0  0  0  0
 27 48  1  0  0  0  0
 27 49  1  0  0  0  0
 28 29  1  0  0  0  0
 29 31  1  0  0  0  0
 29 30  2  0  0  0  0
 31 50  1  0  0  0  0
 31 51  1  0  0  0  0
 31 52  1  0  0  0  0
M  END
>  <SKU>
A15300

>  <Product Name>
Ivachtin

>  <CAS>
745046-84-8

>  <M.Wt>
447.46164

>  <Formula>
C20H21N3O7S

>  <Synonyms>
N/A

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

$$$$
