View source for Mol:LBGPSccp:YS6CA0014:YS6CA0014:AS3PH0002

 
 
 
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   -2.2005   -2.1212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    2.2005   -2.9462    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
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  5  6  1  0 
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  9 10  1  0 
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M  CHG  2   3  -1  21  -1 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  9   8   9  10  11  12  13  14  15  16 
M  SBL   1  1  30 
M  SMT   1 CH2OCO(CH2)4CH3 
M  SBV   1  30    0.0000   -1.3485 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  5  17  18  19  20  21 
M  SBL   2  2  14  15 
M  SMT   2 CH2CHCOO- 
M  SBV   2  14   -0.8248    0.0000 
M  SBV   2  15    0.9393   -0.0001 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  9  22  23  24  25  26  27  28  29  30 
M  SBL   3  2  20  21 
M  SMT   3 CH3(CH2)4COOH^C 
M  SBV   3  20    0.0000   -1.4649 
M  SBV   3  21    0.0000    1.3485 
S  SKP  5 
ID	LBGPSccp:YS6CA0014:YS6CA0014:AS3PH0002:01 
FORMULA	C18H32NO10P 
EXACTMASS	453.1763827589999 
AVERAGEMASS	453.421181 
SMILES	CCCCCC(=O)OCC(OOC(=C)CCCC)COP([O-1])(=O)OCC(N)C([O-1])=O 
M  END