Mol:BMMCPYURS501
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 34 36 0 0 1 0 0 0 0 0999 V2000 | + | 34 36 0 0 1 0 0 0 0 0999 V2000 |
| − | 4.0823 3.0567 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 4.0823 3.0567 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 4.3913 4.0078 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.3913 4.0078 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 3.5823 4.5956 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 3.5823 4.5956 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 2.7733 4.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7733 4.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9945 5.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9945 5.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.9170 -2.4046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.9170 -2.4046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.0510 -2.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.0510 -2.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.0510 -3.9046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.0510 -3.9046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.9170 -4.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.9170 -4.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 10.7830 -3.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.7830 -3.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 10.7830 -2.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.7830 -2.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.9170 -1.4046 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 9.9170 -1.4046 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 10.7260 -0.8168 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 10.7260 -0.8168 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 10.4170 0.1343 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 10.4170 0.1343 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 9.4170 0.1343 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 9.4170 0.1343 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 8.8292 0.9433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.8292 0.9433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6701 2.2477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6701 2.2477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.3424 4.3168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.3424 4.3168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1701 5.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1701 5.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0823 3.0567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0823 3.0567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 5.3001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 5.3001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.1850 -2.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.1850 -2.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.9170 -5.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.9170 -5.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 11.7260 -0.8168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 11.7260 -0.8168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 11.0048 0.9433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 11.0048 0.9433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.1080 -0.8168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.1080 -0.8168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.8347 0.8387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.8347 0.8387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.2469 1.6478 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.2469 1.6478 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0559 2.2355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0559 2.2355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.4379 1.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.4379 1.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.6591 2.4568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.6591 2.4568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.6646 2.3522 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.6646 2.3522 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.7691 1.3577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.7691 1.3577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.5601 3.3468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.5601 3.3468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6 11 1 0 0 0 0 | + | 6 11 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 7 22 2 0 0 0 0 | + | 7 22 2 0 0 0 0 |
| − | 11 10 2 0 0 0 0 | + | 11 10 2 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 23 2 0 0 0 0 | + | 9 23 2 0 0 0 0 |
| − | 10 9 1 0 0 0 0 | + | 10 9 1 0 0 0 0 |
| − | 12 6 1 0 0 0 0 | + | 12 6 1 0 0 0 0 |
| − | 14 13 1 0 0 0 0 | + | 14 13 1 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 17 32 1 0 0 0 0 | + | 17 32 1 0 0 0 0 |
| − | 13 24 1 6 0 0 0 | + | 13 24 1 6 0 0 0 |
| − | 32 31 1 0 0 0 0 | + | 32 31 1 0 0 0 0 |
| − | 31 28 1 0 0 0 0 | + | 31 28 1 0 0 0 0 |
| − | 14 25 1 1 0 0 0 | + | 14 25 1 1 0 0 0 |
| − | 28 27 1 0 0 0 0 | + | 28 27 1 0 0 0 0 |
| − | 1 20 1 0 0 0 0 | + | 1 20 1 0 0 0 0 |
| − | 28 30 1 0 0 0 0 | + | 28 30 1 0 0 0 0 |
| − | 20 4 1 0 0 0 0 | + | 20 4 1 0 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 32 34 2 0 0 0 0 | + | 32 34 2 0 0 0 0 |
| − | 3 2 1 0 0 0 0 | + | 3 2 1 0 0 0 0 |
| − | 28 29 2 0 0 0 0 | + | 28 29 2 0 0 0 0 |
| − | 13 12 1 0 0 0 0 | + | 13 12 1 0 0 0 0 |
| − | 27 16 1 0 0 0 0 | + | 27 16 1 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 1 17 1 4 0 0 0 | + | 1 17 1 4 0 0 0 |
| − | 12 26 1 1 0 0 0 | + | 12 26 1 1 0 0 0 |
| − | 2 18 1 1 0 0 0 | + | 2 18 1 1 0 0 0 |
| − | 15 26 1 6 0 0 0 | + | 15 26 1 6 0 0 0 |
| − | 3 19 1 1 0 0 0 | + | 3 19 1 1 0 0 0 |
| − | 15 14 1 0 0 0 0 | + | 15 14 1 0 0 0 0 |
| − | 3 5 1 6 0 0 0 | + | 3 5 1 6 0 0 0 |
| − | 6 7 1 0 0 0 0 | + | 6 7 1 0 0 0 0 |
| − | 5 21 1 0 0 0 0 | + | 5 21 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMMCPYURS501 | + | ID BMMCPYURS501 |
| − | NAME UDP-D-apiose | + | NAME UDP-D-apiose |
| − | FORMULA C14H22N2O16P2 | + | FORMULA C14H22N2O16P2 |
| − | EXACTMASS 536.0444 | + | EXACTMASS 536.0444 |
| − | AVERAGEMASS 536.2758 | + | AVERAGEMASS 536.2758 |
| − | SMILES OC[C@](O)(C3)[C@@H](O)C(O3)OP(O)(=O)OP(O)(=O)OC[C@@H](O1)[C@@H](O)[C@H](O)[C@H]1N(C=2)C(=O)NC(=O)C2 | + | SMILES OC[C@](O)(C3)[C@@H](O)C(O3)OP(O)(=O)OP(O)(=O)OC[C@@H](O1)[C@@H](O)[C@H](O)[C@H]1N(C=2)C(=O)NC(=O)C2 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01623 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01623 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
34 36 0 0 1 0 0 0 0 0999 V2000
4.0823 3.0567 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
4.3913 4.0078 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.5823 4.5956 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.7733 4.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9945 5.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9170 -2.4046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.0510 -2.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0510 -3.9046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.9170 -4.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7830 -3.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7830 -2.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9170 -1.4046 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
10.7260 -0.8168 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
10.4170 0.1343 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
9.4170 0.1343 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
8.8292 0.9433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6701 2.2477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.3424 4.3168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1701 5.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0823 3.0567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 5.3001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.1850 -2.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.9170 -5.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
11.7260 -0.8168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
11.0048 0.9433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.1080 -0.8168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.8347 0.8387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2469 1.6478 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
8.0559 2.2355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.4379 1.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.6591 2.4568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6646 2.3522 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
5.7691 1.3577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5601 3.3468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6 11 1 0 0 0 0
7 8 1 0 0 0 0
7 22 2 0 0 0 0
11 10 2 0 0 0 0
8 9 1 0 0 0 0
9 23 2 0 0 0 0
10 9 1 0 0 0 0
12 6 1 0 0 0 0
14 13 1 0 0 0 0
2 1 1 0 0 0 0
17 32 1 0 0 0 0
13 24 1 6 0 0 0
32 31 1 0 0 0 0
31 28 1 0 0 0 0
14 25 1 1 0 0 0
28 27 1 0 0 0 0
1 20 1 0 0 0 0
28 30 1 0 0 0 0
20 4 1 0 0 0 0
32 33 1 0 0 0 0
3 4 1 0 0 0 0
32 34 2 0 0 0 0
3 2 1 0 0 0 0
28 29 2 0 0 0 0
13 12 1 0 0 0 0
27 16 1 0 0 0 0
15 16 1 0 0 0 0
1 17 1 4 0 0 0
12 26 1 1 0 0 0
2 18 1 1 0 0 0
15 26 1 6 0 0 0
3 19 1 1 0 0 0
15 14 1 0 0 0 0
3 5 1 6 0 0 0
6 7 1 0 0 0 0
5 21 1 0 0 0 0
S SKP 7
ID BMMCPYURS501
NAME UDP-D-apiose
FORMULA C14H22N2O16P2
EXACTMASS 536.0444
AVERAGEMASS 536.2758
SMILES OC[C@](O)(C3)[C@@H](O)C(O3)OP(O)(=O)OP(O)(=O)OC[C@@H](O1)[C@@H](O)[C@H](O)[C@H]1N(C=2)C(=O)NC(=O)C2
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01623
M END
