Mol:LBF30109SC01

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

32 31  0  0  0  0  0  0  0  0999 V2000 
   1.7224    0.0023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.4371    0.4148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.1515    0.0023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.0077    0.4148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.2933    0.0023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.4187    0.4133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.8635    0.4133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   4.5755    0.0022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   3.8635    1.2355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.1307    0.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.8427    0.4133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.5547    0.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.2667    0.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.9787    0.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.6907    0.4131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.4026    0.0020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.4026   -0.8230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.6882   -1.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.9737   -0.8230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.2592   -1.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.5448   -0.8230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.8328   -1.2340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.1208   -0.8230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.2958   -0.8230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.4187   -1.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.1307   -0.8244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.8427   -1.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.5547   -0.8244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.2667   -1.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.9787   -0.8244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   4.6906   -1.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.4026   -0.8244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
 1  2  1  0 
 2  3  1  0 
 1  4  1  0 
 4  5  1  0 
 5  6  1  0 
 3  7  1  0 
 7  8  1  0 
 7  9  2  0 
 6 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 
20 21  1  0 
21 22  1  0 
22 23  1  0 
23 24  2  0 
24 25  1  0 
25 26  1  0 
26 27  1  0 
27 28  1  0 
28 29  1  0 
29 30  1  0 
30 31  1  0 
31 32  1  0 

S SKP 6 ID LBF30109SC01 FORMULA C30H58O2 EXACTMASS 450.44368110000005 AVERAGEMASS 450.78032 SMILES CCCCCCCCC=CCCCCCCCCCCCCCCCCCCCC(O)=O AUTODRAW FALSE M END