Mol:BMMCPYTY0005
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
17 18 0 0 1 0 0 0 0 0999 V2000
4.0823 -0.1739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.2163 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2163 -1.6739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.0823 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9483 -1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9483 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3503 -0.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0823 -3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8144 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0823 0.8261 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.8913 1.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5823 2.3649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.5823 2.3649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.9945 3.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1701 3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2733 1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 3.0694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10 16 1 6 0 0 0
10 11 1 0 0 0 0
1 2 1 0 0 0 0
1 6 1 0 0 0 0
13 16 1 6 0 0 0
11 12 1 0 0 0 0
2 3 1 0 0 0 0
2 7 2 0 0 0 0
6 5 2 0 0 0 0
13 14 1 0 0 0 0
12 15 1 1 0 0 0
3 4 1 0 0 0 0
12 13 1 0 0 0 0
5 4 1 0 0 0 0
5 9 1 0 0 0 0
10 1 1 0 0 0 0
4 8 2 0 0 0 0
14 17 1 0 0 0 0
S SKP 7
ID BMMCPYTY0005
NAME Thymidine
FORMULA C10H14N2O5
EXACTMASS 242.0902
AVERAGEMASS 242.2286
SMILES OC[C@@H](O1)[C@@H](O)C[C@@H]1N(C=2)C(=O)NC(=O)C(C)2
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00214
M END
</pre>
