Mol:BMFYB7DAi002

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BMFYB7DAi002.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 16 15  0  0  1  0  0  0  0  0999 V2000
    8.0622    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962    0.5000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.3301    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    0.5000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8660    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962   -0.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -0.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9282    0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0622    2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301   -2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  1  0  0  0  0
  5  4  1  0  0  0  0
  7 14  2  0  0  0  0
  7  6  1  0  0  0  0
  1 13  2  0  0  0  0
  4  3  1  0  0  0  0
  6  9  1  6  0  0  0
 15  7  1  0  0  0  0
  2  8  1  1  0  0  0
  2  3  1  0  0  0  0
  8 10  1  0  0  0  0
  6  5  1  0  0  0  0
 10 11  1  0  0  0  0
  2  1  1  0  0  0  0
 10 16  2  0  0  0  0
S  SKP  7
ID	BMFYB7DAi002
NAME	N2-Acetyl-LL-2,6-diamino-pimelic acid
FORMULA	C9H16N2O5
EXACTMASS	232.1059
AVERAGEMASS	232.2338
SMILES	CC(=O)N[C@@H](CCC[C@H](N)C(O)=O)C(O)=O
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C04390
M  END

</pre>

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