Mol:BMAXS5AMs005

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BMAXS5AMs005.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 12 11  0  0  1  0  0  0  0  0999 V2000
    5.4641    2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    1.5000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.5981    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    2.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301    1.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  6  1  6  0  0  0
  2  1  1  0  0  0  0
  1 10  2  0  0  0  0
  2  3  1  0  0  0  0
  4  3  1  0  0  0  0
  5 12  2  0  0  0  0
  4  5  1  0  0  0  0
  5  7  1  0  0  0  0
  1 11  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
S  SKP  7
ID	BMAXS5AMs005
NAME	N5-Ethyl-L-glutamine
FORMULA	C7H14N2O3
EXACTMASS	174.1004
AVERAGEMASS	174.1977
SMILES	CCNC(=O)CC[C@H](N)C(O)=O
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C01047
M  END

</pre>

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