Mol:FL5FAIGS0001

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FL5FAIGS0001.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 34 37  0  0  0  0  0  0  0  0999 V2000
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   -1.2007    0.0422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2007   -2.3117    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2011    0.0421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6302    0.8671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2011    0.8671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6272   -3.1982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4627   -2.4841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3747    1.2969    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6899   -0.4194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9156    2.0674    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4718    3.1982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  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
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  1 18  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  1  0  0  0
 24 23  1  1  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 20 26  1  0  0  0  0
 25 27  1  0  0  0  0
 24 28  1  0  0  0  0
 21 19  1  0  0  0  0
 19  8  1  0  0  0  0
 22 23  1  1  0  0  0
 15 29  1  0  0  0  0
  3 30  1  0  0  0  0
 31 32  1  0  0  0  0
 14 31  1  0  0  0  0
 33 34  1  0  0  0  0
 16 33  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  31  32
M  SBL   1  1  35
M  SMT   1  OCH3
M  SBV   1  35   -0.7994    0.4616
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  33  34
M  SBL   2  1  37
M  SMT   2  OCH3
M  SBV   2  37    0.0000   -0.7878
S  SKP  5
ID	FL5FAIGS0001
FORMULA	C22H22O12
EXACTMASS	478.111126168
AVERAGEMASS	478.40288000000004
SMILES	c(C(=O)1)(c4O)c(cc(c4)O)OC(c(c3)cc(c(c3OC)O)OC)=C1OC(C(O)2)OCC(C(O)2)O
M  END

</pre>

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