Mol:LBF17115SC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 19 18 0 0 0 0 0 0 0 0999 V2000 4.1745 -0.6222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7877 -0.1918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5027 -0.6029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7877 0.6359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5695 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -0.6222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2852 -0.1189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6225 -0.6084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9859 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -0.6084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2255 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8979 -0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5455 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2151 -0.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8655 -0.0969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5351 -0.5768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1827 -0.0681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8524 -0.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5027 -0.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 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 1 5 2 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 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 18 19 1 0 0 0 0 S SKP 5 ID LBF17115SC01 FORMULA C17H32O2 EXACTMASS 268.240230268 AVERAGEMASS 268.43478 SMILES CCCCCCCCCCCCCCC=CC(O)=O M END