Mol:BMCCID--r009
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
11 12 0 0 1 0 0 0 0 0999 V2000
3.5878 1.1891 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 0.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5878 -0.4290 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
5.4049 -0.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2709 -0.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2709 0.8800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4049 1.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5388 0.8800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5388 -0.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.3800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2788 -1.3800 0.0000 C 0 0 0 0 0 0 0 0 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 1 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
2 10 2 0 0 0 0
3 11 1 4 0 0 0
S SKP 7
ID BMCCID--r009
NAME 3-Methylox-indole
FORMULA C9H9NO
EXACTMASS 147.0684
AVERAGEMASS 147.1739
SMILES O=C(N1)C(C)c(c2)c(ccc2)1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02366
M END
</pre>
