Mol:FL3FF8GS0004

<pre>

Copyright: ARM project http://www.metabolome.jp/
 35 38  0  0  0  0  0  0  0  0999 V2000
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    1.0537   -0.4965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0537    0.3285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3392    0.7410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3753    0.3285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0378    2.5737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4354    1.5302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5939    1.8612    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.3622    2.5737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.1472    2.3344    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9089    2.9232    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1352    2.5810    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0898    0.7410    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7293    1.6981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3755    0.7264    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8081    0.3590    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1894    1.7848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4104    0.1683    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1352    1.5431    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
  3 18  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  1  0  0  0
 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
 25 27  1  0  0  0  0
 24 28  1  0  0  0  0
 21 19  1  0  0  0  0
 16 19  1  0  0  0  0
 17 29  1  0  0  0  0
 30 31  1  0  0  0  0
 23 30  1  0  0  0  0
 32 33  1  0  0  0  0
  6 32  1  0  0  0  0
 34 35  1  0  0  0  0
  1 34  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  CH2OH
M  SBV   1  34   -0.9696   -0.1680
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  32  33
M  SBL   2  1  36
M  SMT   2  OCH3
M  SBV   2  36   -0.3711   -0.8553
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  34  35
M  SBL   3  1  38
M  SMT   3 ^ OCH3
M  SBV   3  38    0.5300   -1.0053
S  SKP  5
ID	FL3FF8GS0004
FORMULA	C23H24O12
EXACTMASS	492.126776232
AVERAGEMASS	492.42946
SMILES	OC(C4O)C(OC(CO)C4O)Oc(c(O)1)cccc(C(O3)=CC(=O)c(c32)c(O)cc(c2OC)OC)1
M  END

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