Mol:LBF16000BC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 19 18 0 0 1 0 0 0 0 0999 V2000 -3.6328 -0.2069 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2158 0.3760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7988 -0.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0498 0.3760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4668 -0.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8838 0.3760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3008 -0.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7178 0.3760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1348 -0.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4482 0.3760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0313 -0.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6142 0.3760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1986 -0.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7816 0.3746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3646 -0.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 0.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7988 -0.2069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0796 1.0319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6328 -1.0319 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 16 18 2 0 0 0 0 1 19 1 4 0 0 0 S SKP 5 ID LBF16000BC01 FORMULA C17H34O2 EXACTMASS 270.255880332 AVERAGEMASS 270.45065999999997 SMILES CCC(C)CCCCCCCCCCCCC(O)=O M END