Mol:BMCCPUAP0015
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 27 29 0 0 1 0 0 0 0 0999 V2000 | + | 27 29 0 0 1 0 0 0 0 0999 V2000 |
| − | 3.7321 3.7954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 3.7954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 3.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 3.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 2.2954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 2.2954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 1.7954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 1.7954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 2.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 2.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 3.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 3.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1229 1.6263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1229 1.6263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5296 0.7127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5296 0.7127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5241 0.8172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5241 0.8172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 3.7954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 3.7954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1933 0.0741 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.1933 0.0741 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 3.9854 -0.9041 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 3.9854 -0.9041 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 4.8514 -1.4041 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.8514 -1.4041 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 5.5945 -0.7349 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.5945 -0.7349 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 6.5727 -0.9428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.5727 -0.9428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0718 -1.3108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0718 -1.3108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.9559 -2.3986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.9559 -2.3986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.1878 0.1786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.1878 0.1786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.2418 -0.1997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.2418 -0.1997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1469 -2.9864 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1469 -2.9864 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5591 -2.1773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5591 -2.1773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3379 -3.5742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3379 -3.5742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.7347 -3.7954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7347 -3.7954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.2200 -0.4076 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.2200 -0.4076 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0120 -1.3858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0120 -1.3858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.1981 -0.6155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.1981 -0.6155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.4279 0.5705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.4279 0.5705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 14 18 1 6 0 0 0 | + | 14 18 1 6 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 11 18 1 6 0 0 0 | + | 11 18 1 6 0 0 0 |
| − | 13 12 1 0 0 0 0 | + | 13 12 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 12 16 1 1 0 0 0 | + | 12 16 1 1 0 0 0 |
| − | 13 17 1 1 0 0 0 | + | 13 17 1 1 0 0 0 |
| − | 1 6 2 0 0 0 0 | + | 1 6 2 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 5 4 2 0 0 0 0 | + | 5 4 2 0 0 0 0 |
| − | 4 9 1 0 0 0 0 | + | 4 9 1 0 0 0 0 |
| − | 9 8 1 0 0 0 0 | + | 9 8 1 0 0 0 0 |
| − | 8 7 2 0 0 0 0 | + | 8 7 2 0 0 0 0 |
| − | 7 5 1 0 0 0 0 | + | 7 5 1 0 0 0 0 |
| − | 6 10 1 0 0 0 0 | + | 6 10 1 0 0 0 0 |
| − | 11 9 1 0 0 0 0 | + | 11 9 1 0 0 0 0 |
| − | 25 24 1 0 0 0 0 | + | 25 24 1 0 0 0 0 |
| − | 24 19 1 0 0 0 0 | + | 24 19 1 0 0 0 0 |
| − | 24 27 2 0 0 0 0 | + | 24 27 2 0 0 0 0 |
| − | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
| − | 21 20 1 0 0 0 0 | + | 21 20 1 0 0 0 0 |
| − | 20 23 2 0 0 0 0 | + | 20 23 2 0 0 0 0 |
| − | 20 22 1 0 0 0 0 | + | 20 22 1 0 0 0 0 |
| − | 17 20 1 0 0 0 0 | + | 17 20 1 0 0 0 0 |
| − | 15 19 1 0 0 0 0 | + | 15 19 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMCCPUAP0015 | + | ID BMCCPUAP0015 |
| − | NAME Adenosine 3',5'-bisphosphate | + | NAME Adenosine 3',5'-bisphosphate |
| − | FORMULA C10H15N5O10P2 | + | FORMULA C10H15N5O10P2 |
| − | EXACTMASS 427.0294 | + | EXACTMASS 427.0294 |
| − | AVERAGEMASS 427.2013 | + | AVERAGEMASS 427.2013 |
| − | SMILES Nc(n3)c(n2)c(nc3)n(c2)[C@H](O1)[C@H](O)[C@H](OP(O)(O)=O)[C@@H](COP(O)(O)=O)1 | + | SMILES Nc(n3)c(n2)c(nc3)n(c2)[C@H](O1)[C@H](O)[C@H](OP(O)(O)=O)[C@@H](COP(O)(O)=O)1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00054 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00054 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
27 29 0 0 1 0 0 0 0 0999 V2000
3.7321 3.7954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.2954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.7954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1229 1.6263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5296 0.7127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5241 0.8172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 3.7954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.1933 0.0741 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.9854 -0.9041 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.8514 -1.4041 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.5945 -0.7349 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.5727 -0.9428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0718 -1.3108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9559 -2.3986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1878 0.1786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2418 -0.1997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1469 -2.9864 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
3.5591 -2.1773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3379 -3.5742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7347 -3.7954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.2200 -0.4076 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
8.0120 -1.3858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.1981 -0.6155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.4279 0.5705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
14 18 1 6 0 0 0
13 14 1 0 0 0 0
11 18 1 6 0 0 0
13 12 1 0 0 0 0
11 12 1 0 0 0 0
14 15 1 0 0 0 0
12 16 1 1 0 0 0
13 17 1 1 0 0 0
1 6 2 0 0 0 0
1 2 1 0 0 0 0
2 3 2 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
4 9 1 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
6 10 1 0 0 0 0
11 9 1 0 0 0 0
25 24 1 0 0 0 0
24 19 1 0 0 0 0
24 27 2 0 0 0 0
24 26 1 0 0 0 0
21 20 1 0 0 0 0
20 23 2 0 0 0 0
20 22 1 0 0 0 0
17 20 1 0 0 0 0
15 19 1 0 0 0 0
S SKP 7
ID BMCCPUAP0015
NAME Adenosine 3',5'-bisphosphate
FORMULA C10H15N5O10P2
EXACTMASS 427.0294
AVERAGEMASS 427.2013
SMILES Nc(n3)c(n2)c(nc3)n(c2)[C@H](O1)[C@H](O)[C@H](OP(O)(O)=O)[C@@H](COP(O)(O)=O)1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00054
M END
