View source for Mol:LBGPxpkk:R:16000BC12:16000BC12

 
 
 
 64 64  0  0  0  0  0  0  0  0999 V2000 
   -1.8842    1.8842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3323    1.8842    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0470    1.9113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0809    0.8503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.8702    0.8503    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0809   -0.9845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2576   -0.9845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3663    0.8503    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3987   -0.9845    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5195   -0.9845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3987   -0.2955    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3987   -1.8469    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8740    0.8690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4883    1.8842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4883    1.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9606    1.8842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9606    1.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4329    1.8842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4329    1.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0931    1.8842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0931    1.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8702    2.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1064    2.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7244    1.8842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3425    2.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.5787    2.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1984    1.8842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8148    2.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0814    2.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3310    1.8842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6807    2.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5108    2.2576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4544    0.8403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4544    0.4413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9266    0.8403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9266    0.4413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3989    0.8403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1271    0.8403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1271    0.4413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8363    1.2222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0724    1.2222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6905    0.8403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3086    1.2222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.5447    1.2222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1645    0.8403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7808    1.2222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0475    1.2222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3650    0.8403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7147    1.2222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5108    1.2222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3989    0.4413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0662   -0.9863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5924   -2.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0951   -2.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1545   -1.8537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0951   -1.4174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5924   -1.4174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8420   -1.8537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3700   -1.4073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8674   -1.4073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1169   -0.9863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8674   -0.5501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3700   -0.5501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1205   -0.9863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0 
  4  5  1  1 
  4  6  1  0 
  7  9  1  0 
  9 10  1  0 
  9 11  2  0 
  9 12  1  0 
  8 13  1  0 
 14 15  1  0 
 16 17  1  0 
 18 19  1  0 
 20 21  1  0 
 14 22  1  0 
 14 23  1  0 
 23 24  1  0 
 24 25  1  0 
 16 25  1  0 
 16 26  1  0 
 26 27  1  0 
 27 28  1  0 
 18 28  1  0 
 18 29  1  0 
 29 30  1  0 
 30 31  1  0 
 20 31  1  0 
 33 34  1  0 
 35 36  1  0 
 38 39  1  0 
 33 40  1  0 
 33 41  1  0 
 41 42  1  0 
 42 43  1  0 
 35 43  1  0 
 35 44  1  0 
 44 45  1  0 
 45 46  1  0 
 37 46  1  0 
 37 47  1  0 
 47 48  1  0 
 48 49  1  0 
 38 49  1  0 
 38 50  1  0 
 37 51  1  0 
 10 52  1  0 
 13 50  1  0 
  2  3  1  0 
  4  3  1  0 
  4  8  1  1 
  6  7  1  0 
 53 54  2  0 
 54 55  1  0 
 55 56  2  0 
 56 57  1  0 
 57 58  2  0 
 53 58  1  0 
 12 58  1  0 
  1 32  1  0 
 20 32  1  0 
 59 60  2  0 
 60 61  1  0 
 61 62  2  0 
 62 63  1  0 
 63 64  2  0 
 59 64  1  0 
S  SKP  5 
ID	LBGPxpkk:R:16000BC12:16000BC12:01 
FORMULA	C56H101O6P 
EXACTMASS	900.733577474 
AVERAGEMASS	901.3713009999999 
SMILES	C(CC(C)CCCC(C)CCCC(C)C)CC(CCOC([H])(COCCC(C)CCCC(CCCC(CCCC(C)C)C)C)COP(OC)(Oc(c1)cccc1)=O)C 
M  END