Mol:BMFYS4HOq002

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BMFYS4HOq002.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
  6  5  0  0  1  0  0  0  0  0999 V2000
    2.0000   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.5000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8660    0.5000    0.0000 C   0  0  2  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
    2.0000    1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  4  1  1  0  0  0
  3  2  1  0  0  0  0
  2  1  1  1  0  0  0
  3  5  1  0  0  0  0
  2  6  1  0  0  0  0
S  SKP  7
ID	BMFYS4HOq002
NAME	(S,S)-Butane-2,3-diol
FORMULA	C4H10O2
EXACTMASS	90.068
AVERAGEMASS	90.121
SMILES	C[C@H](O)[C@H](C)O
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C03046
M  END

</pre>

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