Mol:BMMCBZ1Sf036
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 11 11 0 0 0 0 0 0 0 0999 V2000 | + | 11 11 0 0 0 0 0 0 0 0999 V2000 |
| − | 3.7321 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 0.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 1.3170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 1.3170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3660 0.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3660 0.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3660 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3660 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 0 0 0 0 |
| − | 6 5 1 0 0 0 0 | + | 6 5 1 0 0 0 0 |
| − | 5 4 2 0 0 0 0 | + | 5 4 2 0 0 0 0 |
| − | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
| − | 3 2 2 0 0 0 0 | + | 3 2 2 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 8 11 2 0 0 0 0 | + | 8 11 2 0 0 0 0 |
| − | 8 10 2 0 0 0 0 | + | 8 10 2 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMMCBZ1Sf036 | + | ID BMMCBZ1Sf036 |
| − | NAME Phenol sulfate | + | NAME Phenol sulfate |
| − | FORMULA C6H6O4S | + | FORMULA C6H6O4S |
| − | EXACTMASS 173.9986 | + | EXACTMASS 173.9986 |
| − | AVERAGEMASS 174.1754 | + | AVERAGEMASS 174.1754 |
| − | SMILES c(c1)ccc(c1)OS(O)(=O)=O | + | SMILES c(c1)ccc(c1)OS(O)(=O)=O |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02180 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02180 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
11 11 0 0 0 0 0 0 0 0999 V2000
3.7321 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 0.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.3170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 0.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6 1 2 0 0 0 0
6 5 1 0 0 0 0
5 4 2 0 0 0 0
4 3 1 0 0 0 0
3 2 2 0 0 0 0
2 1 1 0 0 0 0
1 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
8 11 2 0 0 0 0
8 10 2 0 0 0 0
S SKP 7
ID BMMCBZ1Sf036
NAME Phenol sulfate
FORMULA C6H6O4S
EXACTMASS 173.9986
AVERAGEMASS 174.1754
SMILES c(c1)ccc(c1)OS(O)(=O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02180
M END
