Mol:BMAXS6ANk004
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 19 18 0 0 1 0 0 0 0 0999 V2000 | + | 19 18 0 0 1 0 0 0 0 0999 V2000 |
| − | 8.9282 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.9282 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0622 2.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 8.0622 2.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 8.0622 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 2.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 2.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 -2.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.4641 -2.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.7942 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.7942 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.9282 3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.9282 3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 -3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 7 1 6 0 0 0 | + | 2 7 1 6 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 1 14 2 0 0 0 0 | + | 1 14 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 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 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 1 15 1 0 0 0 0 | + | 1 15 1 0 0 0 0 |
| − | 6 8 1 0 0 0 0 | + | 6 8 1 0 0 0 0 |
| − | 9 8 1 0 0 0 0 | + | 9 8 1 0 0 0 0 |
| − | 9 13 1 0 0 0 0 | + | 9 13 1 0 0 0 0 |
| − | 9 10 1 6 0 0 0 | + | 9 10 1 6 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 13 18 2 0 0 0 0 | + | 13 18 2 0 0 0 0 |
| − | 13 19 1 0 0 0 0 | + | 13 19 1 0 0 0 0 |
| − | 12 16 2 0 0 0 0 | + | 12 16 2 0 0 0 0 |
| − | 12 17 1 0 0 0 0 | + | 12 17 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMAXS6ANk004 | + | ID BMAXS6ANk004 |
| − | NAME L-Saccharopine | + | NAME L-Saccharopine |
| − | FORMULA C11H20N2O6 | + | FORMULA C11H20N2O6 |
| − | EXACTMASS 276.1321 | + | EXACTMASS 276.1321 |
| − | AVERAGEMASS 276.2863 | + | AVERAGEMASS 276.2863 |
| − | SMILES OC(=O)CC[C@H](NCCCC[C@H](N)C(O)=O)C(O)=O | + | SMILES OC(=O)CC[C@H](NCCCC[C@H](N)C(O)=O)C(O)=O |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00449 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00449 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
19 18 0 0 1 0 0 0 0 0999 V2000
8.9282 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 2.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
8.0622 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 2.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.5981 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 7 1 6 0 0 0
2 1 1 0 0 0 0
1 14 2 0 0 0 0
2 3 1 0 0 0 0
4 3 1 0 0 0 0
5 6 1 0 0 0 0
4 5 1 0 0 0 0
1 15 1 0 0 0 0
6 8 1 0 0 0 0
9 8 1 0 0 0 0
9 13 1 0 0 0 0
9 10 1 6 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
13 18 2 0 0 0 0
13 19 1 0 0 0 0
12 16 2 0 0 0 0
12 17 1 0 0 0 0
S SKP 7
ID BMAXS6ANk004
NAME L-Saccharopine
FORMULA C11H20N2O6
EXACTMASS 276.1321
AVERAGEMASS 276.2863
SMILES OC(=O)CC[C@H](NCCCC[C@H](N)C(O)=O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00449
M END
