Mol:LBF10000BC03
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 18 17 0 0 1 0 0 0 0 0999 V2000 -1.8934 0.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4764 0.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1352 0.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1352 0.1584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1085 0.1584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3124 0.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8998 -0.1584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0749 -0.1584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3377 -0.8730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3571 -1.2705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9446 -0.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1196 -0.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 0.1584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4489 0.9133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8614 0.1988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4809 0.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8934 1.2705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8934 -0.1584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 1 6 1 0 0 0 0 2 9 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 4 10 1 0 0 0 0 5 13 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 3 14 1 0 0 0 0 15 14 1 4 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 S SKP 5 ID LBF10000BC03 FORMULA C16H32O2 EXACTMASS 256.240230268 AVERAGEMASS 256.42408 SMILES CCCCCCC(CCCCCC)CCC(O)=O M END