Mol:BMMCACDEq006
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 8 8 0 0 1 0 0 0 0 0999 V2000 | + | 8 8 0 0 1 0 0 0 0 0999 V2000 |
| − | 3.7321 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4 3 2 0 0 0 0 | + | 4 3 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 2 8 1 1 0 0 0 | + | 2 8 1 1 0 0 0 |
| − | 1 7 1 1 0 0 0 | + | 1 7 1 1 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMMCACDEq006 | + | ID BMMCACDEq006 |
| − | NAME cis-1,2-Dihydro-benzene-1,2-diol | + | NAME cis-1,2-Dihydro-benzene-1,2-diol |
| − | FORMULA C6H8O2 | + | FORMULA C6H8O2 |
| − | EXACTMASS 112.0524 | + | EXACTMASS 112.0524 |
| − | AVERAGEMASS 112.1265 | + | AVERAGEMASS 112.1265 |
| − | SMILES O[C@H](C=1)[C@@H](O)C=CC1 | + | SMILES O[C@H](C=1)[C@@H](O)C=CC1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C04091 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C04091 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
8 8 0 0 1 0 0 0 0 0999 V2000
3.7321 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
2.8660 -0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4 3 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
2 8 1 1 0 0 0
1 7 1 1 0 0 0
S SKP 7
ID BMMCACDEq006
NAME cis-1,2-Dihydro-benzene-1,2-diol
FORMULA C6H8O2
EXACTMASS 112.0524
AVERAGEMASS 112.1265
SMILES O[C@H](C=1)[C@@H](O)C=CC1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C04091
M END
