Mol:LBF18108HO03

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LBF18108HO03.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 22 21  0  0  1  0  0  0  0  0999 V2000
   -4.3696    1.7308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1959    1.7308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2444    1.7308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1473    1.7308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5608    1.7308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5608    2.4685    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1959    2.5558    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4541    1.7308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8666    1.0164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4541    0.3019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8666   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4541   -1.1269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8666   -1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4541   -2.5558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7876    1.7308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3751    1.0164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5502    1.0164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1377    0.3019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9571    1.7308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3696    2.4452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3696    1.0164    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1473    1.7308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3 22  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  4  0  0  0
  2  7  1  4  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  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
 14 13  1  4  0  0  0
  1 15  1  0  0  0  0
  2 18  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 14 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
  4 22  2  0  0  0  0
S  SKP  5
ID	LBF18108HO03
FORMULA	C18H34O4
EXACTMASS	314.24570957599997
AVERAGEMASS	314.46016
SMILES	CCCCCC(O)CC=CC(O)CCCCCCCC(O)=O
M  END

</pre>

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