Mol:FL3FEAGS0020

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Copyright: ARM project http://www.metabolome.jp/
 33 36  0  0  0  0  0  0  0  0999 V2000
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   -2.0513   -1.2960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3502   -1.7007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6492   -1.2960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6492   -0.4866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3502   -0.0817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0519   -1.7007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7530   -1.2960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7530   -0.4866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0519   -0.0817    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0520   -2.3770    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4538   -0.0818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1683   -0.4945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8827   -0.0818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8827    0.7431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1683    1.1556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4538    0.7431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3553   -2.3239    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0906    0.7550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5541   -0.1269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4124    0.7638    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8190    1.4498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3362    2.1887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4783    1.2981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6951    2.6419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5776    2.1217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9722    2.0530    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7081    0.7679    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7691   -0.0978    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6980   -1.6862    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9236   -2.6419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5977    1.2048    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7081    0.5637    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
 18  3  1  0  0  0  0
 20 19  1  1  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  1  0  0  0
 24 19  1  1  0  0  0
 23 25  1  0  0  0  0
 22 26  1  0  0  0  0
 24 27  1  0  0  0  0
 19 28  1  0  0  0  0
 20 29  1  0  0  0  0
 29  1  1  0  0  0  0
 30 31  1  0  0  0  0
  2 30  1  0  0  0  0
 32 33  1  0  0  0  0
 15 32  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 ^ OCH3
M  SBV   1  34    0.6467    0.3902
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   -0.7150   -0.4616
S  SKP  5
ID	FL3FEAGS0020
FORMULA	C23H24O10
EXACTMASS	460.136946988
AVERAGEMASS	460.43066
SMILES	COc(c3OC(O4)C(C(C(O)C4C)O)O)c(O)c(C(=O)1)c(c3)OC(c(c2)ccc(OC)c2)=C1
M  END

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