Mol:LBF20307PG35

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 26  0  0  0  0  0  0  0  0999 V2000
    7.4449   -1.9341    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.9449   -0.3953    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.9449   -0.3953    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.6359   -1.3463    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.2539   -1.3463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3571    0.4137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6848   -1.6553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7638    1.3273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1761    2.1363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5828    3.0499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9950    3.8589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4017    4.7724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8140    5.5814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4769   -2.6335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5258   -2.9425    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.3179   -3.9207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3669   -4.2297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1590   -5.2078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2079   -5.5168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -6.4950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7539   -0.9831    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4449   -1.9341    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7827   -2.2734    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8194    5.4769    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2207    6.4950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 21 22  1  0  0  0  0
  1 22  1  1  0  0  0
  2 21  1  1  0  0  0
  2  3  1  0  0  0  0
  1  4  1  0  0  0  0
  3  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  1  0  0  0
  4  7  1  6  0  0  0
  6  8  1  0  0  0  0
  8  9  2  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
  7 14  2  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
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 15 23  1  6  0  0  0
 13 24  1  0  0  0  0
 13 25  2  0  0  0  0
S  SKP  5
ID	LBF20307PG35
FORMULA	C20H32O5
EXACTMASS	352.224974134
AVERAGEMASS	352.46508
SMILES	C(CC[C@H](O)C=C[C@@H]([C@H]21)[C@@H](CC=CCCCC(O)=O)[C@@H](OO2)C1)CC
M  END

</pre>