
 OpenBabel04291915363D

 50 49  0  0  1  0  0  0  0  0999 V2000
    0.9673    0.0881    0.0341 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1949    0.0881    0.0341 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9359   -1.1086   -0.4295 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.5511   -0.8459   -1.2646 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9482   -2.1859   -0.8469 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0743   -1.6625   -1.9750 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7082   -3.4134   -1.3224 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8098   -1.6321    0.6987 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8932    1.2159    0.4710 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2897    1.2159    0.4710 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0117    0.0498    0.0193 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3607    0.0498    0.0193 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.3979   -0.9415   -0.3648 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9467    2.2770    0.8822 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2057    3.4733    1.3470 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1935    4.5507    1.7641 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4335    5.7777    2.2408 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4212    6.8551    2.6579 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5162    8.3162    3.2256 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.6924    9.5992    3.7223 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9324   10.8262    4.1990 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.3165   11.1948    3.4055 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0814   10.4614    5.3562 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2621   11.0721    6.5454 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2120    9.6036    5.2325 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8877   11.8681    4.6024 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9673    0.0881    0.0341 Na  0  3  0  0  0 15  0  0  0  0  0  0
    0.3790   -2.4209   -2.2688 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6895   -1.3998   -2.8102 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5393   -0.7984   -1.6403 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1299   -3.9265   -2.0621 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8865   -4.0659   -0.4933 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6431   -3.1119   -1.7465 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6641   -1.3707    1.7260 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8123   -1.8828    0.9764 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4009    2.0109    0.7791 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9787    2.2773    0.8813 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5913    3.2100    2.1824 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5898    3.8420    0.5535 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8079    4.8141    0.9286 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8093    4.1821    2.5576 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8190    5.5144    3.0763 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8176    6.1464    1.4473 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0356    7.1185    1.8224 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0371    6.4865    3.4514 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3068    9.8625    2.8868 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3083    9.2305    4.5158 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9257   11.7268    6.6398 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4748   11.5167    5.3589 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3777   12.6915    4.9223 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  9  1  0  0  0  0
  2  3  1  0  0  0  0
  3  5  1  0  0  0  0
  3  8  1  0  0  0  0
  3  4  1  6  0  0  0
  5  7  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  1  0  0  0  0
  6 28  1  0  0  0  0
  6 29  1  0  0  0  0
  6 30  1  0  0  0  0
  7 31  1  0  0  0  0
  7 32  1  0  0  0  0
  7 33  1  0  0  0  0
  8 34  1  0  0  0  0
  8 35  1  0  0  0  0
  9 10  1  0  0  0  0
  9 36  1  0  0  0  0
 10 14  2  0  0  0  0
 10 11  1  0  0  0  0
 11 13  2  0  0  0  0
 11 12  1  0  0  0  0
 14 15  1  0  0  0  0
 14 37  1  0  0  0  0
 15 16  1  0  0  0  0
 15 38  1  0  0  0  0
 15 39  1  0  0  0  0
 16 17  1  0  0  0  0
 16 40  1  0  0  0  0
 16 41  1  0  0  0  0
 17 18  1  0  0  0  0
 17 42  1  0  0  0  0
 17 43  1  0  0  0  0
 18 19  1  0  0  0  0
 18 44  1  0  0  0  0
 18 45  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 46  1  0  0  0  0
 20 47  1  0  0  0  0
 21 26  1  0  0  0  0
 21 23  1  0  0  0  0
 21 22  1  6  0  0  0
 23 25  2  0  0  0  0
 23 24  1  0  0  0  0
 24 48  1  0  0  0  0
 26 49  1  0  0  0  0
 26 50  1  0  0  0  0
M  CHG  2  12  -1  27   1
M  END
>  <SKU>
A10886

>  <Product Name>
Cilastatin sodium

>  <CAS>
81129-83-1

>  <M.Wt>
380.43487

>  <Formula>
C16H25N2NaO5S

>  <Synonyms>
Cilastatin Monosodium Salt

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

$$$$
