Mol:FL3FADCS0008

<pre>

Copyright: ARM project http://www.metabolome.jp/
 42 46  0  0  0  0  0  0  0  0999 V2000
   -1.7504   -0.9441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7504   -1.7691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0359   -2.1816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3215   -1.7691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3215   -0.9441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0359   -0.5318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3930   -2.1816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1074   -1.7691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1074   -0.9441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3930   -0.5318    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3930   -2.8248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4645   -0.5319    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8092    2.3829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5869    1.7937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2569    0.9451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2481    0.1266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6530    0.7214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0448    1.4637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9762    3.0062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5869    2.6732    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6307    0.2976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0359   -3.0062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9804   -0.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7332   -0.8341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4861   -0.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4861    0.4700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7332    0.9045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9804    0.4700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2385    0.9043    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1729   -1.8102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6962   -2.4394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0097   -2.1725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3475   -2.1653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8287   -1.6838    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4292   -2.0008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8327   -2.1911    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4392   -2.4756    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4581   -2.4910    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5562    1.9524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3614    1.4226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9153   -0.5939    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8327   -1.1237    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
  1 12  1  0  0  0  0
 13 14  1  1  0  0  0
 14 15  1  1  0  0  0
 16 15  1  1  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 13  1  0  0  0  0
 13 19  1  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
  6 16  1  0  0  0  0
  3 22  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 23  1  0  0  0  0
  9 23  1  0  0  0  0
 26 29  1  0  0  0  0
 30 31  1  1  0  0  0
 31 32  1  1  0  0  0
 33 32  1  1  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 30  1  0  0  0  0
 30 36  1  0  0  0  0
 31 37  1  0  0  0  0
 32 38  1  0  0  0  0
 33  2  1  0  0  0  0
 39 40  1  0  0  0  0
 18 39  1  0  0  0  0
 41 42  1  0  0  0  0
 25 41  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   -0.4887   -0.4887
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  41  42
M  SBL   2  1  46
M  SMT   2 OCH3
M  SBV   2  46   -0.4292    0.1946
S  SKP  5
ID	FL3FADCS0008
FORMULA	C27H30O15
EXACTMASS	594.15847029
AVERAGEMASS	594.5181
SMILES	C(C5O)OC(C(C5O)O)c(c1O)c(c(C(=O)4)c(OC(=C4)c(c3)cc(OC)c(O)c3)c1C(O2)C(C(C(O)C2CO)O)O)O
M  END

</pre>