Mol:BMAXDP--0011
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
17 17 0 0 1 0 0 0 0 0999 V2000
2.3090 1.7746 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8090 0.2357 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.6180 0.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3090 1.7746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6180 0.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1180 -0.0425 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.6180 -0.9085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1180 -0.0425 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8090 -0.7643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6180 0.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6180 0.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1180 1.6895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1180 1.6895 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.6180 -0.9085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1180 -1.7746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1180 1.6895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
13 12 1 0 0 0 0
12 11 1 0 0 0 0
13 14 1 0 0 0 0
11 17 2 0 0 0 0
11 9 1 0 0 0 0
7 9 1 6 0 0 0
7 6 1 0 0 0 0
7 8 1 0 0 0 0
8 15 2 0 0 0 0
8 16 1 0 0 0 0
4 5 2 0 0 0 0
5 1 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
6 4 1 0 0 0 0
3 10 1 0 0 0 0
S SKP 7
ID BMAXDP--0011
NAME L-Anserine
FORMULA C10H16N4O3
EXACTMASS 240.1222
AVERAGEMASS 240.2592
SMILES NCCC(=O)N[C@H](C(O)=O)Cc(c1)n(C)cn1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01262
M END
</pre>
