Mol:BMFYB5DAk011
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 13 12 0 0 0 0 0 0 0 0999 V2000 | + | 13 12 0 0 0 0 0 0 0 0999 V2000 |
| − | 4.3220 -1.9440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3220 -1.9440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.8220 -1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8220 -1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3220 -1.9440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3220 -1.9440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.8220 -2.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8220 -2.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2321 1.6760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2321 1.6760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 2.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 2.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 2.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 2.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -0.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 0.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 0.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 5 10 2 0 0 0 0 | + | 5 10 2 0 0 0 0 |
| − | 5 11 1 0 0 0 0 | + | 5 11 1 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 3 6 1 0 0 0 0 | + | 3 6 1 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 3 9 1 0 0 0 0 | + | 3 9 1 0 0 0 0 |
| − | 1 7 2 0 0 0 0 | + | 1 7 2 0 0 0 0 |
| − | 6 12 2 0 0 0 0 | + | 6 12 2 0 0 0 0 |
| − | 8 1 1 0 0 0 0 | + | 8 1 1 0 0 0 0 |
| − | 6 13 1 0 0 0 0 | + | 6 13 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMFYB5DAk011 | + | ID BMFYB5DAk011 |
| − | NAME Citric acid | + | NAME Citric acid |
| − | FORMULA C6H8O7 | + | FORMULA C6H8O7 |
| − | EXACTMASS 192.027 | + | EXACTMASS 192.027 |
| − | AVERAGEMASS 192.1235 | + | AVERAGEMASS 192.1235 |
| − | SMILES OC(=O)CC(O)(CC(O)=O)C(O)=O | + | SMILES OC(=O)CC(O)(CC(O)=O)C(O)=O |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00158 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00158 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
13 12 0 0 0 0 0 0 0 0999 V2000
4.3220 -1.9440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8220 -1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3220 -1.9440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8220 -2.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2321 1.6760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 2.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4 5 1 0 0 0 0
2 3 1 0 0 0 0
5 10 2 0 0 0 0
5 11 1 0 0 0 0
3 4 1 0 0 0 0
3 6 1 0 0 0 0
1 2 1 0 0 0 0
3 9 1 0 0 0 0
1 7 2 0 0 0 0
6 12 2 0 0 0 0
8 1 1 0 0 0 0
6 13 1 0 0 0 0
S SKP 7
ID BMFYB5DAk011
NAME Citric acid
FORMULA C6H8O7
EXACTMASS 192.027
AVERAGEMASS 192.1235
SMILES OC(=O)CC(O)(CC(O)=O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00158
M END
