Mol:LBF11000BC11
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 14 13 0 0 1 0 0 0 0 0999 V2000 | + | 14 13 0 0 1 0 0 0 0 0999 V2000 |
| − | -3.3357 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3357 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0399 1.6015 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 0.0399 1.6015 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 1.2600 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2600 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0399 2.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0399 2.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9247 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9247 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3357 2.3135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3357 2.3135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3357 0.8895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3357 0.8895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3074 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3074 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8963 0.8895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8963 0.8895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3074 0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3074 0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8963 -0.5345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8963 -0.5345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3074 -1.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3074 -1.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8963 -1.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8963 -1.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3074 -2.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3074 -2.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 2 4 1 4 0 0 0 | + | 2 4 1 4 0 0 0 |
| − | 3 5 1 0 0 0 0 | + | 3 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 5 7 1 0 0 0 0 | + | 5 7 1 0 0 0 0 |
| − | 1 8 1 0 0 0 0 | + | 1 8 1 0 0 0 0 |
| − | 2 14 1 0 0 0 0 | + | 2 14 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF11000BC11 | + | ID LBF11000BC11 |
| − | FORMULA C12H24O2 | + | FORMULA C12H24O2 |
| − | EXACTMASS 200.17763001199998 | + | EXACTMASS 200.17763001199998 |
| − | AVERAGEMASS 200.31776 | + | AVERAGEMASS 200.31776 |
| − | SMILES CCCCCCCCC(C)CC(O)=O | + | SMILES CCCCCCCCC(C)CC(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
14 13 0 0 1 0 0 0 0 0999 V2000
-3.3357 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0399 1.6015 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
1.2600 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0399 2.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9247 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3357 2.3135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3357 0.8895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3074 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8963 0.8895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3074 0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8963 -0.5345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3074 -1.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8963 -1.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3074 -2.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 0 0 0 0
2 4 1 4 0 0 0
3 5 1 0 0 0 0
5 6 2 0 0 0 0
5 7 1 0 0 0 0
1 8 1 0 0 0 0
2 14 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
S SKP 5
ID LBF11000BC11
FORMULA C12H24O2
EXACTMASS 200.17763001199998
AVERAGEMASS 200.31776
SMILES CCCCCCCCC(C)CC(O)=O
M END
