Mol:LBF18108HO01

<pre>

Copyright: ARM project http://www.metabolome.jp/
 22 22  0  0  1  0  0  0  0  0999 V2000
   -4.2968    1.7861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1232    1.7861    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.1716    1.7861    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.2200    1.7861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4590    1.7861    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.6518    2.5005    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4677    2.4947    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8843    1.7861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2968    2.5005    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2968    1.0716    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3523    1.7861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7648    1.0716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3523    0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7648   -0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3523   -1.0716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7648   -1.7861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3523   -2.5005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6857    1.7861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2733    1.0716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4483    1.0716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0358    0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2200    1.7861    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
  2  6  1  4  0  0  0
  5  7  1  4  0  0  0
  3  6  1  4  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
  5 11  1  0  0  0  0
  8 17  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  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
  1 18  1  0  0  0  0
  2 21  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
  4 22  2  0  0  0  0
S  SKP  5
ID	LBF18108HO01
FORMULA	C18H32O4
EXACTMASS	312.23005951199997
AVERAGEMASS	312.44428
SMILES	C(C(C=CC(O)CCCCCCCC(O)=O)1)(CCCCC)O1
M  END

</pre>