Mol:LBF14105SC01
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 16 15 0 0 0 0 0 0 0 0999 V2000 | + | 16 15 0 0 0 0 0 0 0 0999 V2000 |
− | 3.0910 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0910 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7042 -0.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7042 -0.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.4192 -0.5307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4192 -0.5307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7042 0.7081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7042 0.7081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.4860 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4860 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.8535 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8535 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.2017 -0.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2017 -0.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.5390 -0.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5390 -0.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0976 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0976 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.7315 -0.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7315 -0.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3090 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3090 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1065 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1065 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6015 -0.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6015 -0.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.2615 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2615 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.7977 -0.7081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7977 -0.7081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.4192 -0.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4192 -0.1636 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 |
− | 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 |
− | 1 5 1 0 0 0 0 | + | 1 5 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 2 0 0 0 0 | + | 11 12 2 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 |
− | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
− | S SKP 5 | + | S SKP 5 |
− | ID LBF14105SC01 | + | ID LBF14105SC01 |
− | FORMULA C14H26O2 | + | FORMULA C14H26O2 |
− | EXACTMASS 226.19328007599998 | + | EXACTMASS 226.19328007599998 |
− | AVERAGEMASS 226.35504 | + | AVERAGEMASS 226.35504 |
− | SMILES CCCCC=CCCCCCCCC(O)=O | + | SMILES CCCCC=CCCCCCCCC(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/ 16 15 0 0 0 0 0 0 0 0999 V2000 3.0910 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 -0.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4192 -0.5307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 0.7081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8535 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2017 -0.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -0.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0976 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7315 -0.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1065 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6015 -0.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2615 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7977 -0.7081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4192 -0.1636 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 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 1 5 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 2 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 15 16 1 0 0 0 0 S SKP 5 ID LBF14105SC01 FORMULA C14H26O2 EXACTMASS 226.19328007599998 AVERAGEMASS 226.35504 SMILES CCCCC=CCCCCCCCC(O)=O M END