Mol:LBF20503HO11

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LBF20503HO11.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 24 23  0  0  1  0  0  0  0  0999 V2000
   -4.0370    0.2056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3220   -0.2069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6084    0.2056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6084    1.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3220    1.4403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0370    1.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8948   -0.2055    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.1811    0.2056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4675   -0.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7834    1.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0698    1.4403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3561    1.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3575    1.4403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3575   -0.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0711    0.2056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7847   -0.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6097   -0.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3233    0.2056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0370   -0.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0711    1.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0711    0.2042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7856    1.4417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8961   -1.0292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6106   -1.4417    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  1  0  0  0  0
  5  6  1  0  0  0  0
  1  6  2  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
  4 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
  9 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 13 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 22  1  0  0  0  0
  7 23  1  6  0  0  0
 23 24  1  0  0  0  0
S  SKP  5
ID	LBF20503HO11
FORMULA	C20H30O4
EXACTMASS	334.21440944799997
AVERAGEMASS	334.4498
SMILES	C(CC=CCC(OO)C=CC=CCC=CCCCC(O)=O)=CCC
M  END

</pre>

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