Mol:LBF17115BC01
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 21 20 0 0 1 0 0 0 0 0999 V2000 | + | 21 20 0 0 1 0 0 0 0 0999 V2000 |
− | 4.5981 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 -2.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 4.5981 -2.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
− | 5.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 9.7942 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.7942 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 9.7942 6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.7942 6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 -5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 -6.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -6.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6.3301 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6.3301 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 7.1962 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 7.1962 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 8.0622 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 8.0622 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 8.9282 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.9282 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 8.9282 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.9282 5.0000 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 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
− | 4 1 1 0 0 0 0 | + | 4 1 1 0 0 0 0 |
− | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
− | 6 3 1 0 0 0 0 | + | 6 3 1 0 0 0 0 |
− | 21 7 1 0 0 0 0 | + | 21 7 1 0 0 0 0 |
− | 4 8 1 4 0 0 0 | + | 4 8 1 4 0 0 0 |
− | 3 10 1 0 0 0 0 | + | 3 10 1 0 0 0 0 |
− | 10 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
− | 10 12 1 0 0 0 0 | + | 10 12 1 0 0 0 0 |
− | 5 13 1 0 0 0 0 | + | 5 13 1 0 0 0 0 |
− | 9 7 1 0 0 0 0 | + | 9 7 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 |
− | 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 |
− | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
− | S SKP 5 | + | S SKP 5 |
− | ID LBF17115BC01 | + | ID LBF17115BC01 |
− | FORMULA C19H36O2 | + | FORMULA C19H36O2 |
− | EXACTMASS 296.271530396 | + | EXACTMASS 296.271530396 |
− | AVERAGEMASS 296.48794000000004 | + | AVERAGEMASS 296.48794000000004 |
− | SMILES CCCCCCCCCCCCC(C)CC=C(C)C(O)=O | + | SMILES CCCCCCCCCCCCC(C)CC=C(C)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/ 21 20 0 0 1 0 0 0 0 0999 V2000 4.5981 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 4 1 1 0 0 0 0 4 5 1 0 0 0 0 6 3 1 0 0 0 0 21 7 1 0 0 0 0 4 8 1 4 0 0 0 3 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 5 13 1 0 0 0 0 9 7 1 0 0 0 0 13 14 1 0 0 0 0 14 15 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 20 21 1 0 0 0 0 S SKP 5 ID LBF17115BC01 FORMULA C19H36O2 EXACTMASS 296.271530396 AVERAGEMASS 296.48794000000004 SMILES CCCCCCCCCCCCC(C)CC=C(C)C(O)=O M END