Mol:FL5FAAGS0039

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FL5FAAGS0039.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
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  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
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  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
 15 20  1  0  0  0  0
  8 21  1  0  0  0  0
 23 22  1  1  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  1  0  0  0
 27 22  1  1  0  0  0
 26 28  1  0  0  0  0
 25 29  1  0  0  0  0
 27 30  1  0  0  0  0
 22 31  1  0  0  0  0
 23 19  1  0  0  0  0
 32 33  1  1  0  0  0
 33 34  1  1  0  0  0
 35 34  1  1  0  0  0
 35 36  1  0  0  0  0
 36 32  1  0  0  0  0
 33 37  1  0  0  0  0
 34 38  1  0  0  0  0
 39 40  1  1  0  0  0
 40 41  1  1  0  0  0
 42 41  1  1  0  0  0
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 46 47  1  0  0  0  0
 32 46  1  0  0  0  0
 48 49  1  0  0  0  0
 41 48  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  46  47
M  SBL   1  1  52
M  SMT   1  CH2OH
M  SBV   1  52   -0.3825    0.6625
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  48  49
M  SBL   2  1  54
M  SMT   2  CH2OH
M  SBV   2  54    0.0000    0.5985
S  SKP  5
ID	FL5FAAGS0039
FORMULA	C31H36O18
EXACTMASS	696.190164348
AVERAGEMASS	696.60674
SMILES	C(OC(=C5c(c6)ccc(c6)O)C(c(c(O5)4)c(O)cc(c4)OC(C3O)OC(C)C(C(O)3)O)=O)(O1)C(OC(O2)C(O)C(O)(C2)CO)C(O)C1CO
M  END

</pre>

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