Mol:FL4DAAGI0003

<pre>

Copyright: ARM project http://www.metabolome.jp/
 49 53  0  0  0  0  0  0  0  0999 V2000
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    1.3477   -2.4662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0628   -2.0532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0629   -1.2276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.0366    0.4410    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.8043    0.3362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3155    1.6791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.0366    3.2911    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.7508    0.7954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  4  1  0  0  0  0
  7 11  2  0  0  0  0
  9 12  1  6  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
  6 18  1  0  0  0  0
  8 19  1  1  0  0  0
 15 20  1  0  0  0  0
 21 22  1  1  0  0  0
 22 23  1  1  0  0  0
 24 23  1  1  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 21  1  0  0  0  0
 21 27  1  0  0  0  0
 22 28  1  0  0  0  0
 23 29  1  0  0  0  0
 24 18  1  0  0  0  0
  2 30  1  0  0  0  0
  5 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 33 35  1  0  0  0  0
 36 37  1  1  0  0  0
 37 38  1  1  0  0  0
 39 38  1  1  0  0  0
 39 40  1  0  0  0  0
 40 41  1  0  0  0  0
 41 36  1  0  0  0  0
 36 42  1  0  0  0  0
 37 43  1  0  0  0  0
 38 44  1  0  0  0  0
 39 34  1  0  0  0  0
 33 45  1  0  0  0  0
 46 47  1  0  0  0  0
 41 46  1  0  0  0  0
 48 49  1  0  0  0  0
 26 48  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  46  47
M  SBL   1  1  51
M  SMT   1 ^ CH2OH
M  SBV   1  51    0.4798   -0.6190
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  48  49
M  SBL   2  1  53
M  SMT   2 ^ CH2OH
M  SBV   2  53    0.5742   -0.5379
S  SKP  5
ID	FL4DAAGI0003
FORMULA	C32H42O17
EXACTMASS	698.242199918
AVERAGEMASS	698.6656800000001
SMILES	C(c(c5)ccc(c5)O)(O4)C(C(c(c42)c(cc(c2CCC(C)(C)OC(O3)C(O)C(C(C(CO)3)O)O)OC(O1)C(C(O)C(C(CO)1)O)O)O)=O)O
M  END

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