Mol:LBF23000BC02
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 28 27 0 0 1 0 0 0 0 0999 V2000 -5.6733 0.1217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2562 0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8392 0.1217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0903 0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5073 0.1217 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9242 0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3413 0.1217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7583 0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1753 0.1217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5923 0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0092 0.1217 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4263 0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1581 0.1203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7411 0.7033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3241 0.1203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9071 0.7033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4901 0.1203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0731 0.7033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6561 0.1203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2391 0.7033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8221 0.1203 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4051 0.7033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1228 0.2895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1256 -0.5383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8392 0.7047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8221 -0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0092 -0.7033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5073 -0.7033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 2 3 1 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 15 14 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 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 21 26 1 4 0 0 0 11 27 1 4 0 0 0 5 28 1 4 0 0 0 S SKP 5 ID LBF23000BC02 FORMULA C26H52O2 EXACTMASS 396.396730908 AVERAGEMASS 396.68987999999996 SMILES CCCCC(C)CCCCCC(C)CCCCCCCCCC(C)CC(O)=O M END