
 OpenBabel04291915453D

 64 63  0  0  1  0  0  0  0  0999 V2000
    8.5400    1.6163   -1.3280 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2538    0.9905   -0.8137 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4444    0.4601   -1.9858 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5888   -0.1534    0.1295 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3348   -0.7637    0.6310 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3865   -1.7992    1.4845 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2502   -2.3521    1.9389 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3018   -3.3876    2.7924 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4898   -3.8702    3.1916 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1469   -0.2811    0.2318 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0478   -3.9978    3.2939 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.2384   -4.5282    2.1217 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3745   -5.1131    4.2135 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5467   -5.3936    4.4461 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3487   -5.8450    4.8155 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7288   -7.1428    5.8856 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.5438   -8.1954    5.1394 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5415   -6.6104    7.0624 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1973   -7.8881    6.4980 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9668   -0.0728    0.0600 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4601    1.0329   -0.8518 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0599    1.0329   -0.8518 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5499    2.1021   -1.7335 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4868   -0.0728    0.0600 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9934   -1.1784    0.9718 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.4994   -2.4872    0.4827 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2971   -3.3613    0.1561 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1731   -2.7181    0.3964 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4634   -1.1784    0.9718 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1098    1.9896   -0.5028 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3041    2.4216   -1.9919 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1114    0.8783   -1.8512 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6824    1.7284   -0.2905 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0158   -0.2779   -2.5090 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2085    1.2654   -2.6498 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5390    0.0195   -1.6238 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1586    0.2199    0.9547 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1603   -0.8914   -0.3937 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2994   -2.1700    1.7912 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3373   -1.9813    1.6322 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1414   -4.4873    3.7010 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4953    0.3360   -0.2776 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4764   -3.2598    3.8171 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8098   -5.2662    1.5985 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0026   -3.7229    1.4577 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3330   -4.9687    2.4837 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4086   -5.6201    4.6289 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6259   -7.1501    7.0212 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4331   -8.6933    7.1620 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6275   -8.2614    5.6729 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6101    0.0939    1.0549 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6101   -1.0177   -0.2931 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8168    0.8662   -1.8467 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8168    1.9778   -0.4986 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4166    1.1995    0.1432 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4166    0.0879   -1.2049 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2099    3.0029   -1.3969 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5699    2.1021   -1.7335 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8434    0.8722    0.4131 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8434   -0.2395   -0.9349 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6367   -1.0117    1.9667 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8608   -3.5457    0.0872 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8034   -1.3373    0.0233 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8034   -1.9203    1.5836 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 30  1  0  0  0  0
  1 31  1  0  0  0  0
  1 32  1  0  0  0  0
  2  4  1  0  0  0  0
  2  3  1  0  0  0  0
  2 33  1  0  0  0  0
  3 34  1  0  0  0  0
  3 35  1  0  0  0  0
  3 36  1  0  0  0  0
  4  5  1  0  0  0  0
  4 37  1  0  0  0  0
  4 38  1  0  0  0  0
  5  6  2  0  0  0  0
  5 10  1  0  0  0  0
  6  7  1  0  0  0  0
  6 39  1  0  0  0  0
  7  8  2  0  0  0  0
  7 40  1  0  0  0  0
  8 11  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 41  1  0  0  0  0
 10 42  1  0  0  0  0
 11 13  1  0  0  0  0
 11 12  1  0  0  0  0
 11 43  1  0  0  0  0
 12 44  1  0  0  0  0
 12 45  1  0  0  0  0
 12 46  1  0  0  0  0
 13 15  1  0  0  0  0
 13 14  2  0  0  0  0
 15 16  1  0  0  0  0
 15 47  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 48  1  0  0  0  0
 19 49  1  0  0  0  0
 19 50  1  0  0  0  0
 20 24  1  0  0  0  0
 20 21  1  0  0  0  0
 20 51  1  0  0  0  0
 20 52  1  0  0  0  0
 21 22  1  0  0  0  0
 21 53  1  0  0  0  0
 21 54  1  0  0  0  0
 22 23  1  0  0  0  0
 22 55  1  0  0  0  0
 22 56  1  0  0  0  0
 23 57  1  0  0  0  0
 23 58  1  0  0  0  0
 24 25  1  0  0  0  0
 24 59  1  0  0  0  0
 24 60  1  0  0  0  0
 25 29  1  0  0  0  0
 25 26  1  0  0  0  0
 25 61  1  0  0  0  0
 26 28  1  0  0  0  0
 26 27  2  0  0  0  0
 28 62  1  0  0  0  0
 29 63  1  0  0  0  0
 29 64  1  0  0  0  0
M  END
>  <SKU>
A15219

>  <Product Name>
Reparixin L-lysine salt

>  <CAS>
266359-93-7

>  <M.Wt>
429.574

>  <Formula>
C20H35N3O5S

>  <Synonyms>
Repertaxin L-lysine salt

>  <URL>
https://www.adooq.com/reparixin-l-lysine-salt.html

$$$$
