Mol:EEL0059


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

24 23  0  0  0  0  0  0  0  0999 V2000 
  -5.7365   -0.5492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -6.0612    0.5761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.3058    1.1375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.5820   -0.7132    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.0758    0.2422    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.4386    0.6687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.7240    1.1264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.0100    0.7141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.2957    1.1264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.5812    0.7141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.8669    1.1264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.1524    0.7141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.5618    1.1264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -6.2776   -1.1719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -6.0089   -1.9519    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   1.2763    0.7140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.9907    1.1266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.7053    0.7142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.4197    1.1267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   4.1342    0.7143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   4.8486    1.1269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.5632    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   6.2776    1.1271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   4.8485    1.9519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
 1  2  1  0 
 2  3  1  0 
 1  5  1  0 
 1  4  1  0 
 6  3  1  0 
 7  6  1  0 
 8  7  1  0 
 9  8  1  0 
10  9  1  0 
11 10  1  0 
12 11  1  0 
13 12  1  0 
 1 14  1  0 
14 15  1  0 
13 16  1  0 
16 17  1  0 
17 18  1  0 
18 19  1  0 
19 20  1  0 
20 21  1  0 
21 22  1  0 
22 23  1  0 
21 24  1  0 

S SKP 6 AUTODRAW FALSE ID EEL0059 FORMULA C20H42O3 EXACTMASS 330.31339520999995 AVERAGEMASS 330.54568 SMILES CCC(C)CCCCCCCCCCCCCOCC([H])(O)CO M END