
 OpenBabel04291915433D

 58 58  0  0  1  0  0  0  0  0999 V2000
    1.5133   -7.7547    3.7347 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5861   -8.6365    4.0946 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9445   -8.1819    4.0180 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9703   -6.7421    3.5316 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4113   -6.2657    3.4467 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.7158   -5.8794    4.3970 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5225   -5.1728    2.3962 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9275   -4.7084    2.3135 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7831   -5.2090    3.0375 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2780   -3.7013    1.4118 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2336   -3.1420    0.6029 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.4387   -2.8007    1.2327 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7699   -2.0019   -0.1774 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7587   -2.1910   -1.0219 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2950   -1.0508   -1.8022 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.5159   -0.6337   -2.4055 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7878   -0.0591   -0.9134 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7060   -4.2036   -0.3485 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.5009   -4.5449   -0.9782 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1697   -5.3437    0.4318 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2030   -5.3175    1.6587 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6451   -6.4103   -0.2061 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3606   -1.5084   -2.6464 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.9793   -0.6709   -3.4227 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9769   -1.0992   -4.2131 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6167   -0.2333   -5.0158 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2706    1.0184   -5.0276 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7067   -2.7601   -2.6346 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1219   -3.5517   -1.9008 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6541   -0.6787   -5.8377 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2788   -7.3928    3.0752 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3080   -9.9374    4.5195 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1046  -10.3401    4.5874 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3523  -10.7958    4.8698 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9790   -0.0812   -0.0544 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.5791   -8.2626    3.8536 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6274   -7.4519    2.7149 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5333   -6.8920    4.3674 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4891   -8.7991    3.3343 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3950   -8.2393    4.9868 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4293   -6.1237    4.2170 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5157   -6.6823    2.5648 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8911   -4.3525    2.6667 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2180   -5.5592    1.4460 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2076   -3.3866    1.3341 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3667   -1.0595   -0.0575 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1618   -3.1334   -1.1417 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3060   -7.1311    0.2872 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7043    0.3237   -3.4321 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.2519   -2.0939   -4.2037 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9164   -1.6276   -5.8287 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1231   -0.0439   -6.4261 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2458   -7.0731    3.0182 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9885   -7.7610    2.1693 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3683   -9.7349    4.3404 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2846  -10.4838    4.8172 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1563  -11.7129    5.1693 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3090   -0.0812   -0.0544 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 36  1  0  0  0  0
  1 37  1  0  0  0  0
  1 38  1  0  0  0  0
  2 32  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 39  1  0  0  0  0
  3 40  1  0  0  0  0
  4 41  1  0  0  0  0
  4 42  1  0  0  0  0
  5  7  1  0  0  0  0
  5  6  1  1  0  0  0
  5 31  1  0  0  0  0
  5  4  1  0  0  0  0
  7  8  1  0  0  0  0
  7 43  1  0  0  0  0
  7 44  1  0  0  0  0
  8 10  1  0  0  0  0
  8  9  2  0  0  0  0
 10 45  1  0  0  0  0
 11 13  1  0  0  0  0
 11 18  1  0  0  0  0
 11 12  1  1  0  0  0
 11 10  1  0  0  0  0
 13 14  2  0  0  0  0
 13 46  1  0  0  0  0
 14 15  1  0  0  0  0
 14 47  1  0  0  0  0
 15 23  1  0  0  0  0
 15 17  1  0  0  0  0
 15 16  1  6  0  0  0
 17 18  1  0  0  0  0
 18 20  1  0  0  0  0
 18 19  1  1  0  0  0
 20 22  1  0  0  0  0
 20 21  2  0  0  0  0
 22 48  1  0  0  0  0
 23 24  1  0  0  0  0
 23 28  1  0  0  0  0
 24 25  2  0  0  0  0
 24 49  1  0  0  0  0
 25 26  1  0  0  0  0
 25 50  1  0  0  0  0
 26 30  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 30 51  1  0  0  0  0
 30 52  1  0  0  0  0
 31 53  1  0  0  0  0
 31 54  1  0  0  0  0
 32 34  1  0  0  0  0
 32 33  2  0  0  0  0
 33 55  1  0  0  0  0
 34 56  1  0  0  0  0
 34 57  1  0  0  0  0
 35 58  1  0  0  0  0
M  END
>  <SKU>
A14212

>  <Product Name>
Blasticidin S HCl

>  <CAS>
CAS: 3513-03-9

>  <M.Wt>
458.89988

>  <Formula>
C17H27ClN8O5

>  <Synonyms>
Blasticidine S HCl

>  <URL>
https://www.adooq.com/blasticidin-s-hcl.html

$$$$
