Mol:LBF18000HO29


Copyright: ARM project http://www.metabolome.jp/

24 23  0  0  0  0  0  0  0  0999 V2000 
   5.0036   -0.2084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.7208    0.2056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   6.4377   -0.2084    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   5.7208    1.0334    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   4.2866    0.2056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.5696   -0.2084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.8526    0.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.1358   -0.2084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.4213    0.2041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.7068   -0.2084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.0076    0.2041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.7221   -0.2084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.4365    0.2041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.1510   -0.2084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.8655    0.2041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.5799   -0.2084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.2943    0.2041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.0087   -0.2084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.7232    0.2041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -6.4377   -0.2084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.0076    1.0290    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.7221   -1.0334    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.1510   -1.0334    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.8655    1.0290    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
 1  2  1  0 
 2  3  1  0 
 2  4  2  0 
 1  5  1  0 
 5  6  1  0 
 6  7  1  0 
 7  8  1  0 
 8  9  1  0 
 9 10  1  0 
10 11  1  0 
11 12  1  0 
12 13  1  0 
13 14  1  0 
14 15  1  0 
15 16  1  0 
16 17  1  0 
17 18  1  0 
18 19  1  0 
19 20  1  0 
11 21  1  0 
12 22  1  0 
14 23  1  0 
15 24  1  0 

S SKP 6 ID LBF18000HO29 FORMULA C18H36O6 EXACTMASS 348.251188884 AVERAGEMASS 348.47484 SMILES CCCCCC(O)C(O)CC(O)C(O)CCCCCCCC(O)=O AUTODRAW FALSE M END