Mol:BMCCPUGUr005
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
12 13 0 0 0 0 0 0 0 0999 V2000
4.5981 0.5413 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.5413 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.4587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -0.9587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.4587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5241 -1.9368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5296 -2.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1229 -1.1278 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 2.0413 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.9587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 6 1 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
5 6 1 0 0 0 0
5 4 2 0 0 0 0
9 8 1 0 0 0 0
8 7 2 0 0 0 0
7 5 1 0 0 0 0
4 9 1 0 0 0 0
6 12 2 0 0 0 0
2 10 1 0 0 0 0
3 11 1 0 0 0 0
S SKP 7
ID BMCCPUGUr005
NAME 3-Methyl-guanine
FORMULA C6H7N5O
EXACTMASS 165.065
AVERAGEMASS 165.1528
SMILES NC(=N1)N(C)c(n2)c(nc2)C(=O)1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02230
M END
</pre>
