Mol:LBF18203HP03

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LBF18203HP03.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 25  0  0  1  0  0  0  0  0999 V2000
   -2.7455    1.4480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1940    1.4480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3690    1.4480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0001    1.1888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6410    1.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7875    1.8853    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2368    1.8778    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1902    1.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2455    1.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5469   -0.0320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1902    1.8304    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5469    2.2561    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5731    1.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9986    0.7372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5731    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9986   -0.7372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5731   -1.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9986   -2.2116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5731   -2.9487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3198    1.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7455    0.7372    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7455    2.2116    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3198    2.9487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1940    1.4480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9897    0.8910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 24  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  4  0  0  0
  5  4  1  4  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  3  7  1  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  4  0  0  0
 10  9  1  4  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  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
 19 18  1  4  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
  2 24  2  0  0  0  0
 13 25  1  0  0  0  0
 25 10  2  0  0  0  0
S  SKP  5
ID	LBF18203HP03
FORMULA	C19H32O6
EXACTMASS	356.219888756
AVERAGEMASS	356.45378
SMILES	C(O1)(CC(C=CC)O1)C(OO)CC=CCCCCCCCC(=O)OC
M  END

</pre>

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