Mol:LBF08000HO01
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 1 0 0 0 0 0999 V2000 | + | 11 10 0 0 1 0 0 0 0 0999 V2000 |
| − | 0.5589 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5589 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1419 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 1.1419 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 1.7689 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7689 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3561 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3561 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7744 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7744 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0241 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0241 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6070 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6070 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1901 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1901 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7731 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7731 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3561 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3561 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1419 -1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1419 -1.0876 0.0000 O 0 0 0 0 0 0 0 0 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 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 3 5 2 0 0 0 0 | + | 3 5 2 0 0 0 0 |
| − | 1 6 1 0 0 0 0 | + | 1 6 1 0 0 0 0 |
| − | 6 7 1 0 0 0 0 | + | 6 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 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 2 11 1 4 0 0 0 | + | 2 11 1 4 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF08000HO01 | + | ID LBF08000HO01 |
| − | FORMULA C8H16O3 | + | FORMULA C8H16O3 |
| − | EXACTMASS 160.109944378 | + | EXACTMASS 160.109944378 |
| − | AVERAGEMASS 160.21084 | + | AVERAGEMASS 160.21084 |
| − | SMILES CCCCCCC(O)C(O)=O | + | SMILES CCCCCCC(O)C(O)=O |
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 1 0 0 0 0 0999 V2000
0.5589 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1419 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
1.7689 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3561 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7744 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0241 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6070 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1901 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7731 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3561 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1419 -1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
3 5 2 0 0 0 0
1 6 1 0 0 0 0
6 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
2 11 1 4 0 0 0
S SKP 5
ID LBF08000HO01
FORMULA C8H16O3
EXACTMASS 160.109944378
AVERAGEMASS 160.21084
SMILES CCCCCCC(O)C(O)=O
M END
