Mol:LBF15000SC01
From Metabolomics.JP
(Difference between revisions)
Line 1: | Line 1: | ||
− | + | ||
− | + | ||
− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 17 16 0 0 0 0 0 0 0 0999 V2000 | + | 17 16 0 0 0 0 0 0 0 0999 V2000 |
− | 4.2852 -0.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2852 -0.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.0002 -0.5692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0002 -0.5692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.2852 0.6696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2852 0.6696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.6719 -0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6719 -0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.9844 -0.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9844 -0.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.3231 -0.6146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3231 -0.6146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.6548 -0.1334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6548 -0.1334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.9948 -0.6256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9948 -0.6256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3238 -0.1430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3238 -0.1430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3389 -0.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3389 -0.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0072 -0.1554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0072 -0.1554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.6672 -0.6476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6672 -0.6476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.3382 -0.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3382 -0.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.0009 -0.6586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0009 -0.6586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.6692 -0.1774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6692 -0.1774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.3292 -0.6696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3292 -0.6696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -5.0002 -0.1870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.0002 -0.1870 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 |
− | 1 3 2 0 0 0 0 | + | 1 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 |
− | 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 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 12 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 |
− | 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 |
− | S SKP 5 | + | S SKP 5 |
− | ID LBF15000SC01 | + | ID LBF15000SC01 |
− | FORMULA C15H30O2 | + | FORMULA C15H30O2 |
− | EXACTMASS 242.22458020399998 | + | EXACTMASS 242.22458020399998 |
− | AVERAGEMASS 242.3975 | + | AVERAGEMASS 242.3975 |
− | SMILES CCCCCCCCCCCCCCC(O)=O | + | SMILES CCCCCCCCCCCCCCC(O)=O |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 17 16 0 0 0 0 0 0 0 0999 V2000 4.2852 -0.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0002 -0.5692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2852 0.6696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6719 -0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9844 -0.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3231 -0.6146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6548 -0.1334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9948 -0.6256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3238 -0.1430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3389 -0.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0072 -0.1554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6672 -0.6476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3382 -0.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0009 -0.6586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6692 -0.1774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3292 -0.6696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0002 -0.1870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 4 1 1 0 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 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 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 15 16 1 0 0 0 0 16 17 1 0 0 0 0 S SKP 5 ID LBF15000SC01 FORMULA C15H30O2 EXACTMASS 242.22458020399998 AVERAGEMASS 242.3975 SMILES CCCCCCCCCCCCCCC(O)=O M END