Mol:LBF30109SC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 32 31 0 0 0 0 0 0 0 0999 V2000 2.6359 0.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2491 1.2815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9641 0.8704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2491 2.1092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0309 1.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3544 0.8442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7026 1.3475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0261 0.8731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6284 1.3778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3049 0.9034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9566 1.4066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6331 0.9323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2876 1.4369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9641 0.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9641 -0.1389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3083 -0.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6758 -0.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0171 -0.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3874 -0.0729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9553 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6139 -0.4991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2436 0.0316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 -0.4661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7315 -0.5706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -0.0385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 -1.4864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3509 -2.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6909 -1.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0941 -2.1092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4217 -1.6335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5596 -0.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1894 -0.0069 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 1 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 16 1 0 0 0 0 16 17 1 0 0 0 0 18 17 1 0 0 0 0 18 19 1 0 0 0 0 14 15 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 19 24 1 0 0 0 0 24 25 1 0 0 0 0 26 23 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 25 31 1 0 0 0 0 31 32 1 0 0 0 0 20 32 2 0 0 0 0 S SKP 5 ID LBF30109SC01 FORMULA C30H58O2 EXACTMASS 450.44368110000005 AVERAGEMASS 450.78032 SMILES CCCCCCCCC=CCCCCCCCCCCCCCCCCCCCC(O)=O M END