Mol:LBF12000BC10
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 15 14 0 0 1 0 0 0 0 0999 V2000 | + | 15 14 0 0 1 0 0 0 0 0999 V2000 |
− | -0.4235 0.9301 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -0.4235 0.9301 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
− | -0.4235 1.9178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4235 1.9178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.9734 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9734 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.5623 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5623 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.9734 1.6421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9734 1.6421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.9734 0.2182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9734 0.2182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0378 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0378 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4489 0.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4489 0.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0378 -0.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0378 -0.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4489 -1.2058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4489 -1.2058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0378 -1.9178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0378 -1.9178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2601 -0.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2601 -0.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.6712 0.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6712 0.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4933 0.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4933 0.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.9044 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9044 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 2 1 4 0 0 0 | + | 1 2 1 4 0 0 0 |
− | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
− | 4 6 1 0 0 0 0 | + | 4 6 1 0 0 0 0 |
− | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
− | 4 11 1 0 0 0 0 | + | 4 11 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 |
− | 1 12 1 0 0 0 0 | + | 1 12 1 0 0 0 0 |
− | 3 15 1 0 0 0 0 | + | 3 15 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 |
− | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
− | S SKP 5 | + | S SKP 5 |
− | ID LBF12000BC10 | + | ID LBF12000BC10 |
− | FORMULA C13H26O2 | + | FORMULA C13H26O2 |
− | EXACTMASS 214.19328007599998 | + | EXACTMASS 214.19328007599998 |
− | AVERAGEMASS 214.34433999999996 | + | AVERAGEMASS 214.34433999999996 |
− | SMILES CCCCCC(C)CCCCCC(O)=O | + | SMILES CCCCCC(C)CCCCCC(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/ 15 14 0 0 1 0 0 0 0 0999 V2000 -0.4235 0.9301 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4235 1.9178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9734 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5623 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9734 1.6421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9734 0.2182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0378 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4489 0.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0378 -0.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4489 -1.2058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0378 -1.9178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2601 -0.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6712 0.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4933 0.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9044 0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 4 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 1 7 1 0 0 0 0 4 11 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 1 12 1 0 0 0 0 3 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 S SKP 5 ID LBF12000BC10 FORMULA C13H26O2 EXACTMASS 214.19328007599998 AVERAGEMASS 214.34433999999996 SMILES CCCCCC(C)CCCCCC(O)=O M END