
 OpenBabel04291915443D

 52 54  0  0  1  0  0  0  0  0999 V2000
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    2.3239   -0.0563    0.0804 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9954    0.6120   -0.8714 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3239    1.2804   -1.8231 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9810    1.2804   -1.8231 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3096   -0.7247    1.0322 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1344   -0.7247    1.0322 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7915   -1.3787    1.9635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2355   -1.3787    1.9635 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.9575   -2.0974    2.9869 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3004   -2.0974    2.9869 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9718   -2.7666    3.9380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3004   -3.4359    4.8891 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.0379    1.3023   -1.8544 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.5323    1.1427   -1.6271 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.8995   -0.3310   -1.6880 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.3939   -0.4907   -1.4607 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.7611   -1.9644   -1.5216 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.6949    2.6791   -1.7975 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0011   -2.7209   -0.4444 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3442   -4.0976   -0.5013 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1039    0.2161   -2.4671 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1895   -1.0377   -0.6816 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2423    1.8494   -2.6335 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4650    0.4573   -0.6510 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8399   -0.5700    0.8118 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8399    1.7940   -2.5546 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3238    1.7377   -2.4743 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2755   -1.8923    2.6949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0038   -2.7666    3.9380 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.9119   -4.1082    5.8446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5064   -0.9581    1.3678 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7794    0.9098   -2.8156 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7908    1.5352   -0.6658 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6410   -0.7236   -2.6493 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6524   -0.0981   -0.4995 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5145   -2.6229   -1.9007 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9491   -2.6085   -0.6044 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2596   -2.3283    0.5169 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1098   -4.4535   -1.3727 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8696   -0.1398   -3.3385 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4238   -0.6819    0.1898 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0080    1.4936   -3.5049 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 31  1  0  0  0  0
  2  3  1  0  0  0  0
  2 32  1  0  0  0  0
  3 19  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  4 33  1  0  0  0  0
  5  6  2  0  0  0  0
  5 34  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  3  0  0  0
  7 35  1  0  0  0  0
  8  9  1  0  0  0  0
  8 36  1  0  0  0  0
  9 11  1  0  0  0  0
  9 10  2  0  0  0  0
 11 12  2  0  0  0  0
 11 16  1  0  0  0  0
 12 18  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 37  1  0  0  0  0
 14 17  1  0  0  0  0
 14 15  1  0  0  0  0
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 15 38  1  0  0  0  0
 16 39  1  0  0  0  0
 17 40  1  0  0  0  0
 18 41  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 25  1  0  0  0  0
 20 42  1  0  0  0  0
 21 30  1  0  0  0  0
 21 22  1  0  0  0  0
 21 43  1  0  0  0  0
 22 29  1  0  0  0  0
 22 23  1  0  0  0  0
 22 44  1  0  0  0  0
 23 28  1  0  0  0  0
 23 24  1  0  0  0  0
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 24 25  1  0  0  0  0
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 26 27  1  0  0  0  0
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 26 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
M  END
>  <SKU>
A14552

>  <Product Name>
Isoliquiritin

>  <CAS>
5041-81-6

>  <M.Wt>
418.39398

>  <Formula>
C21H22O9

>  <Synonyms>
Isoliquiritoside

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

$$$$
