Mol:LBF10000HO05
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 13 12 0 0 0 0 0 0 0 0999 V2000 | + | 13 12 0 0 0 0 0 0 0 0999 V2000 |
− | 1.4334 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4334 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0164 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0164 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6434 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6434 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.2306 -0.5912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2306 -0.5912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6489 0.6751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6489 0.6751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.8505 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8505 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2675 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2675 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3156 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3156 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8986 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8986 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4816 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4816 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.0645 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0645 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6475 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6475 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.2306 -0.0921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2306 -0.0921 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 |
− | 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 |
− | S SKP 5 | + | S SKP 5 |
− | ID LBF10000HO05 | + | ID LBF10000HO05 |
− | FORMULA C10H20O3 | + | FORMULA C10H20O3 |
− | EXACTMASS 188.141244506 | + | EXACTMASS 188.141244506 |
− | AVERAGEMASS 188.264 | + | AVERAGEMASS 188.264 |
− | SMILES OCCCCCCCCCC(O)=O | + | SMILES OCCCCCCCCCC(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/ 13 12 0 0 0 0 0 0 0 0999 V2000 1.4334 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0164 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6434 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2306 -0.5912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6489 0.6751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8505 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2675 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3156 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8986 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4816 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0645 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6475 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2306 -0.0921 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 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 S SKP 5 ID LBF10000HO05 FORMULA C10H20O3 EXACTMASS 188.141244506 AVERAGEMASS 188.264 SMILES OCCCCCCCCCC(O)=O M END