Mol:FL5FADGL0012

<pre>

Copyright: ARM project http://www.metabolome.jp/
 43 47  0  0  0  0  0  0  0  0999 V2000
   -1.2161    0.5284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2160   -0.3072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4922   -0.7251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2315   -0.3073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2315    0.5284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4922    0.9463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9552   -0.7251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6789   -0.3072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6790    0.5284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9552    0.9463    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9554   -1.3766    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5904    1.1072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3280    0.6812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0656    1.1072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0656    1.9588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3280    2.3848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5903    1.9589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4921   -1.5604    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5985    2.3190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0804    1.0276    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2566   -0.8848    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2994   -1.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5570   -1.7388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2289   -2.1121    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6053   -2.7871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3478   -2.5882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6758   -2.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8822   -1.0806    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4358   -2.2219    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6781   -2.9876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5766    1.0493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0937    0.4120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3982    0.6824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7274    0.6896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2150    1.1774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8233    0.8564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4370    1.7143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6781    0.3949    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9149    0.2419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3245    3.0505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8987    4.2180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4293   -3.3873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3409   -4.2180    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
  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
 19 15  1  0  0  0  0
  4  3  1  0  0  0  0
  1 20  1  0  0  0  0
 21  8  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  1  0  0  0
 24 25  1  1  0  0  0
 26 25  1  1  0  0  0
 26 27  1  0  0  0  0
 27 22  1  0  0  0  0
 22 28  1  0  0  0  0
 27 29  1  0  0  0  0
 26 30  1  0  0  0  0
 21 23  1  0  0  0  0
 31 32  1  1  0  0  0
 32 33  1  1  0  0  0
 34 33  1  1  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 31  1  0  0  0  0
 31 37  1  0  0  0  0
 32 38  1  0  0  0  0
 33 39  1  0  0  0  0
 34 20  1  0  0  0  0
 40 41  1  0  0  0  0
 16 40  1  0  0  0  0
 42 43  1  0  0  0  0
 25 42  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  40  41
M  SBL   1  1  45
M  SMT   1  OCH3
M  SBV   1  45    0.0035   -0.6657
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  42  43
M  SBL   2  1  47
M  SMT   2  CH2OH
M  SBV   2  47   -0.8240    0.6002
S  SKP  5
ID	FL5FADGL0012
FORMULA	C27H30O16
EXACTMASS	610.153384912
AVERAGEMASS	610.5175
SMILES	OC(C(O)5)C(OCC5O)Oc(c1)cc(c(C3=O)c1OC(=C3OC(C(O)4)OC(C(C(O)4)O)CO)c(c2)ccc(c2OC)O)O
M  END

</pre>