Mol:PR100340

Latest revision as of 16:44, 14 January 2011

 
  ACD/Labs08260914282D 
 
 29 28  0  0  1  0  0  0  0  0  2 V2000 
   20.4293   -5.6920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   21.5681   -5.0049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   22.7325   -5.6475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   23.8713   -4.9605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   25.0357   -5.6031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   26.1745   -4.9160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   27.3389   -5.5587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   28.4777   -4.8716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   29.6421   -5.5624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.1983   -6.2459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.5089   -6.2459    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0 
   11.4670   -6.2459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.9460   -5.4161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   12.9041   -5.4161    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   13.3832   -4.5864    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
   14.2129   -5.0654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   15.0907   -5.6920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   15.8724   -5.0654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   16.6060   -5.6920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   17.5319   -5.0654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   18.5700   -5.6920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.8696   -4.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.9657   -7.6364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   12.5534   -4.1073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   13.8622   -3.7566    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   18.5059   -6.9739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   19.5314   -4.9389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   15.8930   -3.7355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   30.5541   -4.8031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  2  1  1  0  0  0  0 
  3  2  1  0  0  0  0 
  4  3  1  0  0  0  0 
  5  4  1  0  0  0  0 
  6  5  1  0  0  0  0 
  7  6  1  0  0  0  0 
  8  7  1  0  0  0  0 
  9  8  1  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  1  0  0  0  0 
 17 18  1  0  0  0  0 
 18 19  1  0  0  0  0 
 19 20  1  0  0  0  0 
 20 21  1  0  0  0  0 
 11 22  1  0  0  0  0 
 11 23  1  0  0  0  0 
 15 24  2  0  0  0  0 
 15 25  1  0  0  0  0 
 21 26  2  0  0  0  0 
 21 27  1  0  0  0  0 
 18 28  1  6  0  0  0 
  1 27  1  0  0  0  0 
 29  9  1  0  0  0  0 
M  CHG  1  11   1 
S  SKP  7 
CAS_RN	20559-18-6 
NAME	1-Lauroyl-2-Hydroxy-sn-Glycero-3-Phosphocholine 
ID	PR100340 
FORMULA	C20H43NO7P 
EXACTMASS	440.27771424499997 
AVERAGEMASS	440.531721 
SMILES	CCCCCCCCCCCC(=O)OCC(O)COP(O)(=O)OCC[N+1](C)(C)C 
M  END