Mol:BMAXDP--c017
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
16 15 0 0 1 0 0 0 0 0999 V2000
7.1962 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
6.3301 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 3.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -2.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.7321 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.2500 0.0000 Se 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.2500 0.0000 Se 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 4.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -4.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6 16 1 0 0 0 0
12 11 1 0 0 0 0
6 15 2 0 0 0 0
11 4 1 0 0 0 0
7 6 1 0 0 0 0
4 3 1 0 0 0 0
7 10 1 6 0 0 0
3 2 1 0 0 0 0
8 7 1 0 0 0 0
2 1 1 0 0 0 0
8 9 1 0 0 0 0
2 5 1 6 0 0 0
9 12 1 0 0 0 0
1 13 1 0 0 0 0
1 14 2 0 0 0 0
S SKP 7
ID BMAXDP--c017
NAME Seleno-L-homocystine
FORMULA C8H16N2O4Se2
EXACTMASS 363.944
AVERAGEMASS 362.1437
SMILES OC(=O)[C@@H](N)CC[Se][Se]CC[C@H](N)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05707
M END
</pre>
