Mol:LBF10108BC01
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 18 17 0 0 1 0 0 0 0 0999 V2000 | + | 18 17 0 0 1 0 0 0 0 0999 V2000 |
− | 2.7363 -1.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7363 -1.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2163 1.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2163 1.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.3238 1.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3238 1.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9699 1.1374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9699 1.1374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5574 0.4228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5574 0.4228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9699 -0.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9699 -0.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5574 -1.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5574 -1.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9699 -1.7205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9699 -1.7205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5574 -2.4350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5574 -2.4350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0588 -3.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0588 -3.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.8556 -3.4494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8556 -3.4494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6463 -3.9503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6463 -3.9503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.1577 2.9328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1577 2.9328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.1202 3.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1202 3.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4739 2.2657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4739 2.2657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7252 3.9503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7252 3.9503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4263 1.9074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4263 1.9074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.7363 2.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7363 2.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2 17 1 0 0 0 0 | + | 2 17 1 0 0 0 0 |
− | 1 9 1 4 0 0 0 | + | 1 9 1 4 0 0 0 |
− | 4 5 1 0 0 0 0 | + | 4 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 |
− | 1 10 1 0 0 0 0 | + | 1 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 |
− | 2 13 1 0 0 0 0 | + | 2 13 1 0 0 0 0 |
− | 3 16 1 0 0 0 0 | + | 3 16 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 |
− | 1 17 2 0 0 0 0 | + | 1 17 2 0 0 0 0 |
− | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
− | S SKP 5 | + | S SKP 5 |
− | ID LBF10108BC01 | + | ID LBF10108BC01 |
− | FORMULA C16H30O2 | + | FORMULA C16H30O2 |
− | EXACTMASS 254.22458020399998 | + | EXACTMASS 254.22458020399998 |
− | AVERAGEMASS 254.4082 | + | AVERAGEMASS 254.4082 |
− | SMILES CCCCCCCC=C(CCCCCC)C(O)=O | + | SMILES CCCCCCCC=C(CCCCCC)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/ 18 17 0 0 1 0 0 0 0 0999 V2000 2.7363 -1.6401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2163 1.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3238 1.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9699 1.1374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5574 0.4228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9699 -0.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5574 -1.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9699 -1.7205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5574 -2.4350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0588 -3.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8556 -3.4494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6463 -3.9503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1577 2.9328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1202 3.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4739 2.2657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7252 3.9503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4263 1.9074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7363 2.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 17 1 0 0 0 0 1 9 1 4 0 0 0 4 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 1 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 2 13 1 0 0 0 0 3 16 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 1 17 2 0 0 0 0 3 18 1 0 0 0 0 S SKP 5 ID LBF10108BC01 FORMULA C16H30O2 EXACTMASS 254.22458020399998 AVERAGEMASS 254.4082 SMILES CCCCCCCC=C(CCCCCC)C(O)=O M END