Mol:FL5FECGS0022

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Copyright: ARM project http://www.metabolome.jp/
 36 39  0  0  0  0  0  0  0  0999 V2000
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  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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 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
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 17 12  1  0  0  0  0
  1 18  1  0  0  0  0
  8 19  1  0  0  0  0
  3 20  1  0  0  0  0
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 22 23  1  1  0  0  0
 23 24  1  1  0  0  0
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 25 26  1  0  0  0  0
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 27 22  1  0  0  0  0
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  2 33  1  0  0  0  0
 35 36  1  0  0  0  0
 27 35  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    0.0059   -0.7179
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    0.5861    0.2759
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  35  36
M  SBL   3  1  39
M  SMT   3 ^ CH2OH
M  SBV   3  39    0.5482   -0.5597
S  SKP  5
ID	FL5FECGS0022
FORMULA	C23H24O13
EXACTMASS	508.121690854
AVERAGEMASS	508.42886
SMILES	O(c(c1)c(O)ccc1C(O2)=C(C(c(c4O)c2cc(c4OC)OC(C(O)3)OC(CO)C(C3O)O)=O)O)C
M  END

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