Mol:LBF10000HO01
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 13 12 0 0 1 0 0 0 0 0999 V2000 1.1419 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7249 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3519 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9391 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3574 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5589 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0241 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6071 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1901 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7731 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3561 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9391 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7249 -1.0876 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 3 5 2 0 0 0 0 1 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 2 13 1 4 0 0 0 S SKP 5 ID LBF10000HO01 FORMULA C10H20O3 EXACTMASS 188.141244506 AVERAGEMASS 188.264 SMILES CCCCCCCCC(O)C(O)=O M END
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