Mol:BMCCID--o008

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Copyright: ARM project http://www.metabolome.jp/
 13 14  0  0  1  0  0  0  0  0999 V2000
    5.0485   -0.5386    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6418    0.3749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6473    0.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5733   -1.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5733   -2.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4394   -2.7077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3054   -2.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3054   -1.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4394   -0.7077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9781    1.0135    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.2872    1.9646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.8056    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6180    2.7077    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 10 12  1  4  0  0  0
 11 13  2  0  0  0  0
 10 11  1  0  0  0  0
  5  4  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  9  4  1  0  0  0  0
  8  9  2  0  0  0  0
  3  2  2  0  0  0  0
  2  1  1  0  0  0  0
  1  8  1  0  0  0  0
  9  3  1  0  0  0  0
  3 10  1  0  0  0  0
S  SKP  7
ID	BMCCID--o008
NAME	3-Indole-glycolaldehyde
FORMULA	C10H9NO2
EXACTMASS	175.0633
AVERAGEMASS	175.184
SMILES	O=CC(O)c(c1)c(c2)c(ccc2)n1
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C03230
M  END

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