Mol:LBF22506SC01


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

24 23  0  0  0  0  0  0  0  0999 V2000 
   0.4175    0.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.2970    0.0007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.1295    0.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.9545    0.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.6689    0.4146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.3809    0.0036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   4.0929    0.4146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   4.8049    0.0036    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   4.0929    1.2368    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.1220    0.0007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.8365    0.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.5510    0.0007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.3760    0.0007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.0904    0.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.8049    0.0007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.8049   -0.8243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.0904   -1.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.3760   -0.8243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.5510   -0.8243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.8365   -1.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.1245   -0.8257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.4125   -1.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.2995   -0.8257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.0115   -1.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
 1  2  1  0 
 1  3  1  0 
 3  4  2  0 
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 5  6  1  0 
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 7  9  2  0 
 2 10  2  0 
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14 15  1  0 
15 16  2  0 
16 17  1  0 
17 18  1  0 
18 19  2  0 
19 20  1  0 
20 21  1  0 
21 22  1  0 
22 23  1  0 
23 24  1  0 

S SKP 6 ID LBF22506SC01 FORMULA C22H34O2 EXACTMASS 330.255880332 AVERAGEMASS 330.50416000000007 SMILES C(CCC(O)=O)=CCC=CCC=CCC=CCC=CCCCCC AUTODRAW FALSE M END