Mol:LBF10000BC02
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 18 17 0 0 1 0 0 0 0 0999 V2000 -3.6423 1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1446 1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4823 1.4240 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8120 0.4769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4823 0.4769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9899 0.4769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5788 -0.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2433 -0.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6544 -0.9471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2312 1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6423 2.1360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6423 0.7120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8201 1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 0.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8201 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -0.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8201 -1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -2.1360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3 2 1 4 0 0 0 3 5 1 0 0 0 0 4 6 1 0 0 0 0 5 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 3 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 1 13 1 0 0 0 0 2 18 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 S SKP 5 ID LBF10000BC02 FORMULA C16H32O2 EXACTMASS 256.240230268 AVERAGEMASS 256.42408 SMILES CCCCCCCCC(CCCCCC)C(O)=O M END