Mol:FLIAAACS0003

<pre>

Copyright: ARM project http://www.metabolome.jp/
 40 44  0  0  0  0  0  0  0  0999 V2000
   -0.8226   -0.7369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8226   -1.5618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1081   -1.9744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6064   -1.5618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6064   -0.7369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1081   -0.3244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3208   -1.9744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0353   -1.5618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0353   -0.7369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3208   -0.3244    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3208   -2.6175    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5368   -0.3245    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8238    0.7993    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0944    0.3782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3259    1.1881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0944    2.0027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8238    2.4240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5925    1.6141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6323    3.1811    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1329    2.7385    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1350    2.1688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2943    0.6089    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8503    1.8315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4317    1.0541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7392    0.5425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7750    0.5620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1836    1.0953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2974    1.5078    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7392    0.0220    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7750    0.0207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7230   -2.7614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4499   -3.1811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1769   -2.7614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1769   -1.9220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4499   -1.5022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7230   -1.9220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9034   -3.1808    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1081   -2.6602    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7392    1.0336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9034    1.5760    0.0000 O   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
  1 12  1  0  0  0  0
 14 13  1  1  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  1  0  0  0
 18 13  1  1  0  0  0
 17 19  1  0  0  0  0
 16 20  1  0  0  0  0
 18 21  1  0  0  0  0
 15 22  1  0  0  0  0
  6 14  1  0  0  0  0
 21 23  1  0  0  0  0
 24 25  1  1  0  0  0
 25 26  1  1  0  0  0
 27 26  1  1  0  0  0
 27 28  1  0  0  0  0
 28 24  1  0  0  0  0
 25 29  1  0  0  0  0
 26 30  1  0  0  0  0
 27 23  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
 36 31  1  0  0  0  0
  8 36  1  0  0  0  0
 33 37  1  0  0  0  0
  3 38  1  0  0  0  0
 39 40  1  0  0  0  0
 25 39  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  39  40
M  SBL   1  1  44
M  SMT   1  CH2OH
M  SBV   1  44    0.0000   -0.4910
S  SKP  5
ID	FLIAAACS0003
FORMULA	C26H28O14
EXACTMASS	564.147905604
AVERAGEMASS	564.49212
SMILES	c(c51)(C(=O)C(=CO5)c(c4)ccc(c4)O)c(cc(O)c1C(C(O)2)OC(COC(C3O)OCC3(CO)O)C(O)C2O)O
M  END

</pre>