Mol:LBF20406AM20
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 29 28 0 0 0 0 0 0 0 0999 V2000 -5.0933 0.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0933 -1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2683 0.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2683 -1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5547 -0.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5547 -0.3217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 0.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 0.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3023 -0.3217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5058 -0.6228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5887 0.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3023 -0.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5887 -1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1249 -0.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8385 -1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5521 -0.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1249 -0.3217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8385 0.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5526 -0.3238 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8392 0.9144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5052 0.0887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2234 -0.3173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9341 0.1016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1723 0.9253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8868 1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7557 -0.4831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5058 -0.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 2 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 3 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 6 10 2 0 0 0 0 9 11 1 0 0 0 0 2 12 1 0 0 0 0 1 12 1 0 0 0 0 11 13 1 0 0 0 0 14 10 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 13 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 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 S SKP 5 ID LBF20406AM20 FORMULA C26H44N2O EXACTMASS 400.34536404 AVERAGEMASS 400.64043999999996 SMILES C(CCC)CC=CCC=CCC=CCC=CCCCC(=O)NC=CN(CC)CC M END