Mol:LBGPxc-p:18000SC01::OPP--0002


29 28  0  0  0  0  0  0  0  0999 V2000 
  -0.2818   -6.1205    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.2818   -5.2956    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.2818   -6.9455    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0 
   0.6594   -6.1205    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.9775   -6.1205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.1525   -6.1205    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.9775   -4.6555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.2630   -4.2431    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.9775   -3.3070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.1525   -3.3070    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.1525   -2.4821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.8669   -2.0696    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.4381   -2.0696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.8506   -1.3552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.1362   -0.9427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.5486   -0.2283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.1658    0.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.2467    0.8986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.4677    1.3111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.0553    2.0255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.7697    2.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.3572    3.1524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.0716    3.5648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.6592    4.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.3736    4.6917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.9611    5.4061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.6755    5.8186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.2630    6.5330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.9775    6.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
 1  2  2  0 
 1  3  1  0 
 1  4  1  0 
 5  6  1  0 
 1  6  1  0 
 5  7  1  0 
 7  9  1  0 
 7  8  1  0 
 9 10  1  0 
10 11  1  0 
11 12  2  0 
11 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  1  0 
24 25  1  0 
25 26  1  0 
26 27  1  0 
27 28  1  0 
28 29  1  0 

M CHG 1 3 -1 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 7 8 M SBL 1 2 6 7 M SMT 1 CHOH M SBV 1 6 0.0000 -1.4649 M SBV 1 7 0.0000 -1.4649 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 15 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 M SAL 2 6 24 25 26 27 28 29 M SBL 2 1 7 M SMT 2 CH2OCO(CH2)16CH3 M SBV 2 7 -0.0000 -1.3485 S SKP 5 ID LBGPxc-p:18000SC01::OPP--0002:01 FORMULA C21H42O7P EXACTMASS 437.26681520799997 AVERAGEMASS 437.52774100000005 SMILES CCCCCCCCCCCCCCCCCC(=O)OCC(O)COP([O-1])(O)=O M END