Mol:LBF22000HO02
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 25 24 0 0 1 0 0 0 0 0999 V2000 -7.8592 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1447 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4302 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7158 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0013 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2868 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5724 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8579 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 -0.2062 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4302 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1447 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8592 -0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1447 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 0.6187 0.0000 O 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 3 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 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 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 22 24 2 0 0 0 0 20 25 1 4 0 0 0 S SKP 5 ID LBF22000HO02 FORMULA C22H44O3 EXACTMASS 356.329045274 AVERAGEMASS 356.58296 SMILES C(O)(=O)CC(CCCCCCCCCCCCCCCCCCC)O M END
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