Mol:LBF20000AM01
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 25 24 0 0 0 0 0 0 0 0999 V2000 -4.3075 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3075 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4825 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4825 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7689 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0553 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2303 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 -0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5166 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1971 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7689 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0553 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9107 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6243 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3379 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2303 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5166 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1971 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9107 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6243 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3383 -0.1121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 1.1261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 0.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0055 -0.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 0.3004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 2 4 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 2 8 1 0 0 0 0 1 8 1 0 0 0 0 9 7 1 0 0 0 0 9 10 1 0 0 0 0 3 11 1 0 0 0 0 11 12 1 0 0 0 0 13 10 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 12 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 20 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 S SKP 5 ID LBF20000AM01 FORMULA C22H45NO2 EXACTMASS 355.345029689 AVERAGEMASS 355.59824000000003 SMILES C(CCC(=O)NCCO)CCCCCCCCCCCCCCCC M END
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