Mol:LBF18208SC01
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 20 19 0 0 0 0 0 0 0 0999 V2000 | + | 20 19 0 0 0 0 0 0 0 0999 V2000 |
− | 3.6877 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6877 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.2598 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2598 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.8648 -0.6373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8648 -0.6373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.2598 0.6841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2598 0.6841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.1377 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1377 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5052 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5052 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9827 0.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9827 0.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4327 -0.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4327 -0.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.9102 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9102 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3602 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3602 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2448 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2448 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.7948 -0.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7948 -0.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2898 0.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2898 0.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.8398 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8398 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.3623 0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3623 0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8573 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8573 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.3798 0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3798 0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.8473 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8473 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.3423 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3423 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.8648 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.8648 -0.6291 0.0000 C 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 |
− | 2 4 2 0 0 0 0 | + | 2 4 2 0 0 0 0 |
− | 1 5 1 0 0 0 0 | + | 1 5 1 0 0 0 0 |
− | 5 6 1 0 0 0 0 | + | 5 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 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
− | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
− | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
− | 15 14 1 0 0 0 0 | + | 15 14 1 0 0 0 0 |
− | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
− | 16 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
− | 17 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
− | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
− | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
− | S SKP 5 | + | S SKP 5 |
− | ID LBF18208SC01 | + | ID LBF18208SC01 |
− | FORMULA C18H32O2 | + | FORMULA C18H32O2 |
− | EXACTMASS 280.240230268 | + | EXACTMASS 280.240230268 |
− | AVERAGEMASS 280.44548000000003 | + | AVERAGEMASS 280.44548000000003 |
− | SMILES CCCCCCCC=CC=CCCCCCCC(O)=O | + | SMILES CCCCCCCC=CC=CCCCCCCC(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/ 20 19 0 0 0 0 0 0 0 0999 V2000 3.6877 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2598 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8648 -0.6373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2598 0.6841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1377 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5052 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9827 0.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4327 -0.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9102 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3602 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2448 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7948 -0.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2898 0.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8398 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3623 0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8573 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3798 0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8473 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3423 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8648 -0.6291 0.0000 C 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 2 4 2 0 0 0 0 1 5 1 0 0 0 0 5 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 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 15 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 S SKP 5 ID LBF18208SC01 FORMULA C18H32O2 EXACTMASS 280.240230268 AVERAGEMASS 280.44548000000003 SMILES CCCCCCCC=CC=CCCCCCCC(O)=O M END