Mol:BMSUM6Ke--07
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 20 20 0 0 1 0 0 0 0 0999 V2000 | + | 20 20 0 0 1 0 0 0 0 0999 V2000 |
| − | 3.2601 0.6585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2601 0.6585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2601 -0.3415 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 3.2601 -0.3415 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 2.9511 -1.2925 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 2.9511 -1.2925 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 3.7601 -1.8803 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 3.7601 -1.8803 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 4.5691 -1.2925 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.5691 -1.2925 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 5.5691 -1.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.5691 -1.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1261 1.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1261 1.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3090 -0.0324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3090 -0.0324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -1.6015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -1.6015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7601 -2.8803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7601 -2.8803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2601 -0.3415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2601 -0.3415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.0691 -2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.0691 -2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1261 2.1585 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1261 2.1585 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1261 2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1261 2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.1261 2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.1261 2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1261 3.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1261 3.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.0691 -2.1585 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.0691 -2.1585 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.0691 -3.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.0691 -3.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.0691 -1.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.0691 -1.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0691 -2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0691 -2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3 2 1 0 0 0 0 | + | 3 2 1 0 0 0 0 |
| − | 2 11 1 0 0 0 0 | + | 2 11 1 0 0 0 0 |
| − | 5 11 1 6 0 0 0 | + | 5 11 1 6 0 0 0 |
| − | 5 4 1 0 0 0 0 | + | 5 4 1 0 0 0 0 |
| − | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 4 10 1 6 0 0 0 | + | 4 10 1 6 0 0 0 |
| − | 3 9 1 6 0 0 0 | + | 3 9 1 6 0 0 0 |
| − | 6 12 1 0 0 0 0 | + | 6 12 1 0 0 0 0 |
| − | 12 17 1 0 0 0 0 | + | 12 17 1 0 0 0 0 |
| − | 17 20 1 0 0 0 0 | + | 17 20 1 0 0 0 0 |
| − | 17 19 1 0 0 0 0 | + | 17 19 1 0 0 0 0 |
| − | 17 18 2 0 0 0 0 | + | 17 18 2 0 0 0 0 |
| − | 2 8 1 4 0 0 0 | + | 2 8 1 4 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
| − | 7 13 1 0 0 0 0 | + | 7 13 1 0 0 0 0 |
| − | 13 16 1 0 0 0 0 | + | 13 16 1 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 13 15 2 0 0 0 0 | + | 13 15 2 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMSUM6Ke--07 | + | ID BMSUM6Ke--07 |
| − | NAME D-Tagatose 1,6-bisphosphate | + | NAME D-Tagatose 1,6-bisphosphate |
| − | FORMULA C6H14O12P2 | + | FORMULA C6H14O12P2 |
| − | EXACTMASS 339.996 | + | EXACTMASS 339.996 |
| − | AVERAGEMASS 340.1156 | + | AVERAGEMASS 340.1156 |
| − | SMILES O[C@@H]([C@@H](COP(O)(O)=O)1)[C@H](O)C(O)(O1)COP(O)(O)=O | + | SMILES O[C@@H]([C@@H](COP(O)(O)=O)1)[C@H](O)C(O)(O1)COP(O)(O)=O |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03785 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03785 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
20 20 0 0 1 0 0 0 0 0999 V2000
3.2601 0.6585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2601 -0.3415 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
2.9511 -1.2925 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.7601 -1.8803 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.5691 -1.2925 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.5691 -1.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1261 1.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3090 -0.0324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.6015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7601 -2.8803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2601 -0.3415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0691 -2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1261 2.1585 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
3.1261 2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1261 2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1261 3.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.0691 -2.1585 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
7.0691 -3.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.0691 -1.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0691 -2.1585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 2 1 0 0 0 0
2 11 1 0 0 0 0
5 11 1 6 0 0 0
5 4 1 0 0 0 0
4 3 1 0 0 0 0
5 6 1 0 0 0 0
4 10 1 6 0 0 0
3 9 1 6 0 0 0
6 12 1 0 0 0 0
12 17 1 0 0 0 0
17 20 1 0 0 0 0
17 19 1 0 0 0 0
17 18 2 0 0 0 0
2 8 1 4 0 0 0
2 1 1 0 0 0 0
1 7 1 0 0 0 0
7 13 1 0 0 0 0
13 16 1 0 0 0 0
13 14 1 0 0 0 0
13 15 2 0 0 0 0
S SKP 7
ID BMSUM6Ke--07
NAME D-Tagatose 1,6-bisphosphate
FORMULA C6H14O12P2
EXACTMASS 339.996
AVERAGEMASS 340.1156
SMILES O[C@@H]([C@@H](COP(O)(O)=O)1)[C@H](O)C(O)(O1)COP(O)(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03785
M END
