Mol:BMAXS4CAi001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 12 11 0 0 1 0 0 0 0 0999 V2000 | + | 12 11 0 0 1 0 0 0 0 0999 V2000 |
| − | 6.4860 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.4860 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.6200 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 5.6200 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 1.5900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 1.5900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 1.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 1.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.6200 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.6200 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.7540 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7540 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8879 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8879 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.3520 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.3520 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.4860 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.4860 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 0.0900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 0.0900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 1.5900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 1.5900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.7540 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7540 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 5 1 1 0 0 0 | + | 2 5 1 1 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 1 8 2 0 0 0 0 | + | 1 8 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 4 10 2 0 0 0 0 | + | 4 10 2 0 0 0 0 |
| − | 4 11 1 0 0 0 0 | + | 4 11 1 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 1 9 1 0 0 0 0 | + | 1 9 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 12 2 0 0 0 0 | + | 6 12 2 0 0 0 0 |
| − | 6 7 1 0 0 0 0 | + | 6 7 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMAXS4CAi001 | + | ID BMAXS4CAi001 |
| − | NAME N-Acetyl-L-aspartic acid | + | NAME N-Acetyl-L-aspartic acid |
| − | FORMULA C6H9NO5 | + | FORMULA C6H9NO5 |
| − | EXACTMASS 175.048 | + | EXACTMASS 175.048 |
| − | AVERAGEMASS 175.1394 | + | AVERAGEMASS 175.1394 |
| − | SMILES CC(=O)N[C@@H](CC(O)=O)C(O)=O | + | SMILES CC(=O)N[C@@H](CC(O)=O)C(O)=O |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01042 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01042 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
12 11 0 0 1 0 0 0 0 0999 V2000
6.4860 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6200 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.7321 1.5900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6200 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.7540 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8879 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3520 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.4860 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.0900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.5900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7540 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 5 1 1 0 0 0
2 1 1 0 0 0 0
1 8 2 0 0 0 0
2 3 1 0 0 0 0
4 10 2 0 0 0 0
4 11 1 0 0 0 0
3 4 1 0 0 0 0
1 9 1 0 0 0 0
5 6 1 0 0 0 0
6 12 2 0 0 0 0
6 7 1 0 0 0 0
S SKP 7
ID BMAXS4CAi001
NAME N-Acetyl-L-aspartic acid
FORMULA C6H9NO5
EXACTMASS 175.048
AVERAGEMASS 175.1394
SMILES CC(=O)N[C@@H](CC(O)=O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01042
M END
