Mol:BMAXB5AKi001

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BMAXB5AKi001.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 12 11  0  0  1  0  0  0  0  0999 V2000
    4.5981   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.2500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7321    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    0.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301    1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
 10  1  2  0  0  0  0
  1  2  1  0  0  0  0
  2  7  1  6  0  0  0
  4  6  1  0  0  0  0
  5  4  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
  8 12  2  0  0  0  0
S  SKP  7
ID	BMAXB5AKi001
NAME	N-Acetyl-L-leucine
FORMULA	C8H15NO3
EXACTMASS	173.1051
AVERAGEMASS	173.2096
SMILES	CC(C)C[C@H](NC(C)=O)C(O)=O
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C02710
M  END

</pre>

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