Mol:BMCCPUAP0024
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
26 28 0 0 1 0 0 0 0 0999 V2000
3.7321 3.0970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.5970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.5970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.0970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.5970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.5970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1229 0.9279 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5296 0.0143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5241 0.1188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 3.0970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.1933 -0.6243 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.9854 -1.6025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8514 -2.1025 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.5945 -1.4333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.5727 -1.6412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9559 -3.0970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1878 -0.5198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2418 -0.8981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.2200 -1.1060 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
8.0120 -2.0842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.4279 -0.1279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.1981 -1.3139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.8672 -0.5708 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
10.6104 -1.2399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.1241 0.0984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.5364 0.1724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
23 25 1 0 0 0 0
19 21 1 0 0 0 0
23 24 2 0 0 0 0
19 22 1 0 0 0 0
23 26 1 0 0 0 0
22 23 1 0 0 0 0
5 6 1 0 0 0 0
3 2 2 0 0 0 0
13 16 1 1 0 0 0
6 1 2 0 0 0 0
6 10 1 0 0 0 0
5 7 1 0 0 0 0
13 14 1 0 0 0 0
2 1 1 0 0 0 0
11 9 1 0 0 0 0
9 4 1 0 0 0 0
9 8 1 0 0 0 0
11 12 1 0 0 0 0
11 17 1 6 0 0 0
4 5 2 0 0 0 0
4 3 1 0 0 0 0
8 7 2 0 0 0 0
12 13 1 0 0 0 0
14 17 1 6 0 0 0
14 15 1 0 0 0 0
15 18 1 0 0 0 0
S SKP 7
ID BMCCPUAP0024
NAME dADP
FORMULA C10H15N5O9P2
EXACTMASS 411.0345
AVERAGEMASS 411.2019
SMILES Nc(n3)c(n2)c(nc3)n(c2)[C@@H](C1)O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00206
M END
</pre>
