
 OpenBabel04291915483D

 69 73  0  0  1  0  0  0  0  0999 V2000
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    0.2400    1.3737    0.1478 C   0  0  1  0  0  0  0  0  0  0  0  0
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   -1.2544    1.0975    0.1181 C   0  0  1  0  0  0  0  0  0  0  0  0
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   -1.2636    1.3399   -2.3211 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3239   -1.0339   -0.1112 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9984   -2.1954   -0.2362 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0144    2.4063    0.2589 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.7559    2.8708    1.1875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5088    2.1302    0.2292 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.2688    3.4390    0.3700 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.0104    4.0903   -0.4386 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6072    2.2989   -1.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.3718    6.0037    1.5246 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0899   -0.0280    3.6596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5091   -0.8821    2.3194 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.9661   -1.1514    2.2905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3753   -2.3021    2.1667 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8428   -0.1319    2.4002 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2064   -0.3839    2.3731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1660   -0.0178    1.2463 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8761    1.2049    1.3779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7491   -2.1909    2.1786 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.6971   -1.9965    2.1995 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6472    3.3316   -0.8898 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.1822    4.2529   -0.7907 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.0921   -3.0553    3.2517 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6281    5.5957    0.6020 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9536    6.7572    0.7270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6756    8.0006    0.8608 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9897    8.0006    0.8608 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7307    6.7245    0.7235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7307    9.2767    0.9981 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7260    6.7572    0.7270 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7160    3.9834    0.4286 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4630    0.0976    0.0105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6736    0.2434   -1.2220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0866   -0.4835   -1.3003 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3217   -2.6338    0.5262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3632    0.6367    2.1954 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0866   -0.7490    1.1677 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6736   -0.0221    1.2459 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7623    1.8582   -1.9635 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4500    2.9508   -1.0987 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7414    0.5374    2.4722 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4649   -1.0352    3.1817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4649   -0.8483    1.4444 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9280    1.0105    1.3570 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6176    1.6693    2.3065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0671    4.4230   -1.3229 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0427   -3.9769    2.9531 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1596    8.8892    0.9564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0353    5.9159    0.6365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3458    6.7616   -0.1512 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3458    6.5747    1.5860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0353   10.0853    1.0850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3458    9.2396    1.8728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3458    9.4265    0.1355 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8196    1.1006    0.1184 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8196   -0.3104   -0.9121 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8196   -0.4974    0.8252 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 44  1  0  0  0  0
  1  2  1  0  0  0  0
  1  7  2  0  0  0  0
  2  4  1  0  0  0  0
  2 16  1  0  0  0  0
  2  3  1  6  0  0  0
  4 11  1  0  0  0  0
  4 10  1  1  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 45  1  0  0  0  0
  5 46  1  0  0  0  0
  6  9  2  0  0  0  0
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  7  8  1  0  0  0  0
  8 47  1  0  0  0  0
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 13 14  1  0  0  0  0
 13 29  1  1  0  0  0
 13 21  1  0  0  0  0
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 14 15  1  1  0  0  0
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 23 24  1  1  0  0  0
 24 26  1  0  0  0  0
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 27 53  1  0  0  0  0
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 44 69  1  0  0  0  0
M  END
>  <SKU>
A16893

>  <Product Name>
Brusatol

>  <CAS>
14907-98-3

>  <M.Wt>
520.52568

>  <Formula>
C26H32O11

>  <Synonyms>
BRN 1444847

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

$$$$
