Mol:LBF20406PH01


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

29 28  0  0  0  0  0  0  0  0999 V2000 
   0.2425   -0.0096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.9572    0.4029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.6716   -0.0096    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
   0.9572    1.2279    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.4722    0.4029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.1866   -0.0096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.8986    0.4014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.7236    0.4014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.4381   -0.0111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.1526    0.4014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.9776    0.4014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.4650   -0.4293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.9489   -1.2279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.1239   -1.2279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.4095   -0.8154    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.6950   -1.2279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.8700   -1.2279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.1555   -0.8154    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.4411   -1.2279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.2709   -0.8168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.9829   -1.2279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.6949   -0.8168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.3861    0.4029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.1005   -0.0096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.8150    0.4029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   4.6400    0.4029    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
   4.6400    1.2279    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   5.4650    0.4029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   4.6400   -0.4221    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  2  0 
 8  9  1  0 
 9 10  1  0 
10 11  2  0 
11 12  1  0 
12 13  1  0 
13 14  2  0 
14 15  1  0 
15 16  1  0 
16 17  2  0 
17 18  1  0 
18 19  1  0 
19 20  1  0 
20 21  1  0 
21 22  1  0 
 3 23  1  0 
23 24  1  0 
24 25  1  0 
25 26  1  0 
26 27  1  0 
26 28  1  0 
26 29  2  0 

S SKP 6 ID LBF20406PH01 FORMULA C22H38NO5P EXACTMASS 427.2487598409999 AVERAGEMASS 427.51462100000003 SMILES C(CCCC=CCC=CCC=CCC=CCCCCC)(NCCOP(O)(O)=O)=O AUTODRAW FALSE M END