Mol:FL3FE9GS0011

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Copyright: ARM project http://www.metabolome.jp/
 31 34  0  0  0  0  0  0  0  0999 V2000
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    1.6567    1.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2225   -0.1638    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  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
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  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
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 22 23  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
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 23 29  1  0  0  0  0
 24 18  1  0  0  0  0
 30 31  1  0  0  0  0
  2 30  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  30  31
M  SBL   1  1  34
M  SMT   1 ^ OCH3
M  SBV   1  34    1.1105   -0.2052
S  SKP  5
ID	FL3FE9GS0011
FORMULA	C22H22O9
EXACTMASS	430.126382302
AVERAGEMASS	430.40468000000004
SMILES	COc(c4O)c(c(c(c4)3)C(=O)C=C(O3)c(c2)cccc2)OC(O1)C(O)C(C(O)C(C)1)O
M  END

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