Mol:FL5FAEGS0003

<pre>

Copyright: ARM project http://www.metabolome.jp/
 46 50  0  0  0  0  0  0  0  0999 V2000
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  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
  4  3  1  0  0  0  0
  1 19  1  0  0  0  0
 16 20  1  0  0  0  0
 21  8  1  0  0  0  0
 22 23  1  1  0  0  0
 23 24  1  1  0  0  0
 25 24  1  1  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 22  1  0  0  0  0
 22 28  1  0  0  0  0
 23 29  1  0  0  0  0
 24 30  1  0  0  0  0
 25 19  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 18  1  0  0  0  0
 40 41  1  0  0  0  0
 36 40  1  0  0  0  0
 42 43  2  0  0  0  0
 42 44  1  0  0  0  0
 27 42  1  0  0  0  0
 45 46  1  0  0  0  0
 15 45  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 ^ CH2OH
M  SBV   1  45    0.6677   -0.5997
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  3  42  43  44
M  SBL   2  1  48
M  SMT   2 ^ COOH
M  SBV   2  48    0.5602   -0.6427
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  45  46
M  SBL   3  1  50
M  SMT   3  OCH3
M  SBV   3  50   -0.7794   -0.4501
S  SKP  5
ID	FL5FAEGS0003
FORMULA	C28H30O18
EXACTMASS	654.143214156
AVERAGEMASS	654.527
SMILES	COc(c5)c(cc(c5)C(=C4O)Oc(c1)c(C4=O)c(OC(O3)C(C(O)C(O)C3CO)O)cc1OC(C(O)2)OC(C(O)=O)C(O)C2O)O
M  END

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