Mol:BMFYB2SFb002
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 10 0 0 0 0 0 0 0 0999 V2000 | + | 11 10 0 0 0 0 0 0 0 0999 V2000 |
| − | 3.7321 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -1.5670 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.5670 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3660 -0.7010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3660 -0.7010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3660 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3660 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 1.4330 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.4330 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5981 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5981 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.5981 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.5981 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 2.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 2.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 8 10 2 0 0 0 0 | + | 8 10 2 0 0 0 0 |
| − | 7 1 1 0 0 0 0 | + | 7 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 |
| − | 3 5 1 0 0 0 0 | + | 3 5 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 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 11 1 0 0 0 0 | + | 8 11 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMFYB2SFb002 | + | ID BMFYB2SFb002 |
| − | NAME Choline sulfate | + | NAME Choline sulfate |
| − | FORMULA C5H14NO4S | + | FORMULA C5H14NO4S |
| − | EXACTMASS 184.0643 | + | EXACTMASS 184.0643 |
| − | AVERAGEMASS 184.235 | + | AVERAGEMASS 184.235 |
| − | SMILES C[N+1](C)(C)CCOS(O)(=O)=O | + | SMILES C[N+1](C)(C)CCOS(O)(=O)=O |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00919 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00919 |
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 10 0 0 0 0 0 0 0 0999 V2000
3.7321 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.5670 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
2.3660 -0.7010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.4330 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
3.5981 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8 9 2 0 0 0 0
8 10 2 0 0 0 0
7 1 1 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 5 1 0 0 0 0
3 4 1 0 0 0 0
3 6 1 0 0 0 0
7 8 1 0 0 0 0
8 11 1 0 0 0 0
S SKP 7
ID BMFYB2SFb002
NAME Choline sulfate
FORMULA C5H14NO4S
EXACTMASS 184.0643
AVERAGEMASS 184.235
SMILES C[N+1](C)(C)CCOS(O)(=O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00919
M END
