
 OpenBabel04291915443D

 53 56  0  0  1  0  0  0  0  0999 V2000
   16.0876   -5.3446    1.8969 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9140   -4.6479    1.6501 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9659   -3.3781    1.1975 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8296   -2.7035    0.9585 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8812   -1.4395    0.5080 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7449   -0.7649    0.2690 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5570   -1.3543    0.4806 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1539   -2.7887    0.9859 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8005    0.5943   -0.2155 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6641    1.2689   -0.4545 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7124    2.4498   -0.8754 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6508    3.0800   -1.0986 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7025    4.3440   -1.5492 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9884    1.1837   -0.4271 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0272    0.5670   -0.2086 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5662    5.0186   -1.7882 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6178    6.2827   -2.2387 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4815    6.9573   -2.4777 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4629    2.4906   -0.8871 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5334    8.2270   -2.9303 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3598    8.9238   -3.1772 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.6948   10.3202   -3.6753 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.5039   10.2200   -4.9581 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.8389   11.6165   -5.4562 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.6480   11.5163   -6.7391 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.6039    9.0174   -1.9787 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9342   10.7527   -6.4686 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6901   10.6591   -7.6670 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6374   12.3298   -5.7089 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7054    9.5067   -4.7054 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4933   11.0336   -3.9280 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.8518   -6.3277    2.2476 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.6593   -4.8286    2.6398 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.6572   -5.4152    0.9939 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9167   -3.1565    1.1211 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.7942   -0.9865    0.3454 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5285   -1.4343    0.5104 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.1823   -2.7087    0.9561 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7512    0.8160   -0.2919 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6533    4.5657   -1.6256 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5308    6.7356   -2.4013 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0226    1.6116   -0.5732 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7881    8.4078   -3.9200 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2665   10.8363   -2.9324 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9323    9.7040   -5.7010 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4106   12.1325   -4.7134 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7443   11.9689   -7.7039 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6984    9.7697   -6.1179 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5058   11.2687   -5.7257 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1718   10.1913   -8.3404 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1192   11.8620   -6.3823 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2237    9.9745   -4.0320 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9750   10.5658   -4.6014 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  1  0  0  0  0
  3  4  2  0  0  0  0
  3  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4 35  1  0  0  0  0
  5  6  2  0  0  0  0
  5 36  1  0  0  0  0
  6  9  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7 37  1  0  0  0  0
  8 38  1  0  0  0  0
  9 10  2  0  0  0  0
  9 14  1  0  0  0  0
 10 11  1  0  0  0  0
 10 39  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 19  1  0  0  0  0
 13 16  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 16 17  2  0  0  0  0
 16 40  1  0  0  0  0
 17 18  1  0  0  0  0
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 18 20  1  0  0  0  0
 18 19  2  0  0  0  0
 19 42  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 26  1  0  0  0  0
 21 43  1  0  0  0  0
 22 31  1  0  0  0  0
 22 23  1  0  0  0  0
 22 44  1  0  0  0  0
 23 30  1  0  0  0  0
 23 24  1  0  0  0  0
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 24 29  1  0  0  0  0
 24 25  1  0  0  0  0
 24 46  1  0  0  0  0
 25 27  1  0  0  0  0
 25 26  1  0  0  0  0
 25 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 50  1  0  0  0  0
 29 51  1  0  0  0  0
 30 52  1  0  0  0  0
 31 53  1  0  0  0  0
M  END
>  <SKU>
A14578

>  <Product Name>
Ononin

>  <CAS>
486-62-4

>  <M.Wt>
430.40468

>  <Formula>
C22H22O9

>  <Synonyms>
N/A

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

$$$$
