Mol:BMMCLA--p003
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 9 9 0 0 0 0 0 0 0 0999 V2000 | + | 9 9 0 0 0 0 0 0 0 0999 V2000 |
| − | 3.2601 1.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2601 1.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9511 0.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9511 0.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7601 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7601 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5691 0.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5691 0.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2601 1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2601 1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.1569 -0.4907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.1569 -0.4907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.5201 0.6274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.5201 0.6274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 0.0093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 0.0093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7601 -1.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7601 -1.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5 4 1 0 0 0 0 | + | 5 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 5 1 0 0 0 0 | + | 1 5 1 0 0 0 0 |
| − | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
| − | 2 8 2 0 0 0 0 | + | 2 8 2 0 0 0 0 |
| − | 3 9 2 0 0 0 0 | + | 3 9 2 0 0 0 0 |
| − | 4 6 1 0 0 0 0 | + | 4 6 1 0 0 0 0 |
| − | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMMCLA--p003 | + | ID BMMCLA--p003 |
| − | NAME 2-Dehydro-pantolactone | + | NAME 2-Dehydro-pantolactone |
| − | FORMULA C6H8O3 | + | FORMULA C6H8O3 |
| − | EXACTMASS 128.0473 | + | EXACTMASS 128.0473 |
| − | AVERAGEMASS 128.1259 | + | AVERAGEMASS 128.1259 |
| − | SMILES O=C(O1)C(=O)C(C)(C)C1 | + | SMILES O=C(O1)C(=O)C(C)(C)C1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01125 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01125 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
9 9 0 0 0 0 0 0 0 0999 V2000
3.2601 1.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9511 0.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7601 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5691 0.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2601 1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1569 -0.4907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5201 0.6274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.0093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7601 -1.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5 4 1 0 0 0 0
3 2 1 0 0 0 0
2 1 1 0 0 0 0
1 5 1 0 0 0 0
4 3 1 0 0 0 0
2 8 2 0 0 0 0
3 9 2 0 0 0 0
4 6 1 0 0 0 0
4 7 1 0 0 0 0
S SKP 7
ID BMMCLA--p003
NAME 2-Dehydro-pantolactone
FORMULA C6H8O3
EXACTMASS 128.0473
AVERAGEMASS 128.1259
SMILES O=C(O1)C(=O)C(C)(C)C1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01125
M END
