Mol:BMCCPTFLq001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 23 24 0 0 1 0 0 0 0 0999 V2000 | + | 23 24 0 0 1 0 0 0 0 0999 V2000 |
| − | 8.0622 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.9282 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.9282 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.7942 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.7942 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.7942 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.7942 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.9282 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.9282 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0622 1.7500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 8.0622 1.7500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 1.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 7.1962 1.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0622 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.9282 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.9282 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0622 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.4641 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.5981 -0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 10.6603 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.6603 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.9282 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.9282 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 3 2 1 0 0 0 0 | + | 3 2 1 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 1 9 2 0 0 0 0 | + | 1 9 2 0 0 0 0 |
| − | 10 4 1 0 0 0 0 | + | 10 4 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 9 8 1 0 0 0 0 | + | 9 8 1 0 0 0 0 |
| − | 8 7 1 0 0 0 0 | + | 8 7 1 0 0 0 0 |
| − | 7 6 1 0 0 0 0 | + | 7 6 1 0 0 0 0 |
| − | 6 5 1 0 0 0 0 | + | 6 5 1 0 0 0 0 |
| − | 5 10 2 0 0 0 0 | + | 5 10 2 0 0 0 0 |
| − | 4 18 2 0 0 0 0 | + | 4 18 2 0 0 0 0 |
| − | 2 19 2 0 0 0 0 | + | 2 19 2 0 0 0 0 |
| − | 6 11 1 4 0 0 0 | + | 6 11 1 4 0 0 0 |
| − | 7 12 1 4 0 0 0 | + | 7 12 1 4 0 0 0 |
| − | 8 13 1 0 0 0 0 | + | 8 13 1 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | 17 20 1 0 0 0 0 | + | 17 20 1 0 0 0 0 |
| − | 14 21 1 1 0 0 0 | + | 14 21 1 1 0 0 0 |
| − | 15 22 1 6 0 0 0 | + | 15 22 1 6 0 0 0 |
| − | 16 23 1 1 0 0 0 | + | 16 23 1 1 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMCCPTFLq001 | + | ID BMCCPTFLq001 |
| − | NAME 6,7-Dimethyl-8-(1-D-ribityl)-lumazine | + | NAME 6,7-Dimethyl-8-(1-D-ribityl)-lumazine |
| − | FORMULA C13H20N4O6 | + | FORMULA C13H20N4O6 |
| − | EXACTMASS 328.1382 | + | EXACTMASS 328.1382 |
| − | AVERAGEMASS 328.3212 | + | AVERAGEMASS 328.3212 |
| − | SMILES OC[C@@H](O)[C@@H](O)[C@@H](O)CN(C(C)2)C(=N1)C(=NC(C)2)C(=O)NC(=O)1 | + | SMILES OC[C@@H](O)[C@@H](O)[C@@H](O)CN(C(C)2)C(=N1)C(=NC(C)2)C(=O)NC(=O)1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C04332 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C04332 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
23 24 0 0 1 0 0 0 0 0999 V2000
8.0622 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 1.7500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
7.1962 1.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
7.1962 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.5981 -0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.7321 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 4 1 0 0 0 0
3 2 1 0 0 0 0
2 1 1 0 0 0 0
1 9 2 0 0 0 0
10 4 1 0 0 0 0
9 10 1 0 0 0 0
9 8 1 0 0 0 0
8 7 1 0 0 0 0
7 6 1 0 0 0 0
6 5 1 0 0 0 0
5 10 2 0 0 0 0
4 18 2 0 0 0 0
2 19 2 0 0 0 0
6 11 1 4 0 0 0
7 12 1 4 0 0 0
8 13 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
15 16 1 0 0 0 0
16 17 1 0 0 0 0
17 20 1 0 0 0 0
14 21 1 1 0 0 0
15 22 1 6 0 0 0
16 23 1 1 0 0 0
S SKP 7
ID BMCCPTFLq001
NAME 6,7-Dimethyl-8-(1-D-ribityl)-lumazine
FORMULA C13H20N4O6
EXACTMASS 328.1382
AVERAGEMASS 328.3212
SMILES OC[C@@H](O)[C@@H](O)[C@@H](O)CN(C(C)2)C(=N1)C(=NC(C)2)C(=O)NC(=O)1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C04332
M END
