Mol:LBGPx-cp::18000SC01:OPP--0002


29 28  0  0  0  0  0  0  0  0999 V2000 
   4.6528    1.3115    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
   4.6528    2.1363    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   4.6528    0.4865    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0 
   5.5941    1.3115    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   2.9572    1.3115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.7822    1.3115    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   2.9572    2.7764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.2428    3.1889    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   1.8303    2.4745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.2428    1.7601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   1.0054    2.4745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.0054    1.6496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.1805    1.6496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.1805    0.8246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.6445    0.8246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.6445   -0.0003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.4694   -0.0003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.4694   -0.8252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.2943   -0.8252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.2943   -1.6502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.1193   -1.6502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.1193   -2.4751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.9442   -2.4751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.9442   -3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.7691   -3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.7691   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.5941   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.9572    4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.7822    4.1250    0.0000 O   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 28  1  0 
 7  8  1  0 
 8  9  1  0 
 9 10  2  0 
 9 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  1  0 
24 25  1  0 
25 26  1  0 
26 27  1  0 
28 29  1  0 

M CHG 1 3 -1 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 15 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 M SAL 1 6 22 23 24 25 26 27 M SBL 1 2 6 7 M SMT 1 CHOCO(CH2)16CH3 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 2 28 29 M SBL 2 1 7 M SMT 2 CH2OH M SBV 2 7 0.0000 -1.3485 S SKP 5 ID LBGPx-cp::18000SC01:OPP--0002:01 FORMULA C21H42O7P EXACTMASS 437.26681520799997 AVERAGEMASS 437.52774100000005 SMILES CCCCCCCCCCCCCCCCCC(=O)OC(CO)COP([O-1])(O)=O M END