Mol:LBF13000BC06
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 18 17 0 0 1 0 0 0 0 0999 V2000 -2.7664 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7313 2.8480 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9442 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5332 2.1360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9442 1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5332 0.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9442 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5332 -0.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9442 -1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5332 -2.1360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9442 -2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5332 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3553 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7664 3.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7664 2.1360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6955 2.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0165 1.6148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7285 2.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 2 12 1 4 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 2 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 2 18 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 S SKP 5 ID LBF13000BC06 FORMULA C16H32O2 EXACTMASS 256.240230268 AVERAGEMASS 256.42408 SMILES CCCCCCCCCCCC(CCC)C(O)=O M END
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