Mol:LBF18306HO02
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 21 20 0 0 0 0 0 0 0 0999 V2000 -0.4379 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2634 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9086 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3375 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7664 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4809 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1954 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9099 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6243 -0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9099 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0704 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8679 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6188 -0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3254 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0129 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6179 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1954 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9099 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6243 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 10 12 2 0 0 0 0 1 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 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 S SKP 5 ID LBF18306HO02 FORMULA C18H30O3 EXACTMASS 294.21949482599996 AVERAGEMASS 294.429 SMILES OCCCCC=CC=CC=CCCCCCCCC(O)=O M END