Mol:LBF20406SF05

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LBF20406SF05.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 30 29  0  0  0  0  0  0  0  0999 V2000
    7.1962   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0622   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6603    4.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.5263    6.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3923    6.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3923    7.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.3301   -4.0000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.1961   -4.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1961   -5.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0622   -6.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.4641   -2.5000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -2.5000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.8660   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -4.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1961   -7.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9282   -7.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -4.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  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
  1 14  2  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
 15 21  1  6  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  4  0  0  0
 16 26  1  6  0  0  0
 20 27  1  0  0  0  0
 20 28  2  0  0  0  0
 24 29  1  0  0  0  0
 24 30  2  0  0  0  0
S  SKP  5
ID	LBF20406SF05
FORMULA	C23H37NO5S
EXACTMASS	439.239243989
AVERAGEMASS	439.60962000000006
SMILES	OC(=O)CCC[C@@H]([C@@H](C=CC=CC=CCC=CCCCCC)SCC(N)C(O)=O)O
M  END

</pre>

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