Mol:LBF18203HO01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 21 20 0 0 1 0 0 0 0 0999 V2000 -0.6576 -0.2128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0299 -0.2128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6888 -0.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4033 -0.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1178 -0.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8322 -0.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5467 -0.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2612 -0.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9756 -0.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6901 -0.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4046 -0.6803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6901 0.5572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2901 -0.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1426 -0.1440 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8576 -0.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5451 -0.2128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1776 -0.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0576 -0.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6901 -0.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4046 -0.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1764 0.6803 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 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 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 14 21 1 4 0 0 0 S SKP 5 ID LBF18203HO01 FORMULA C18H32O3 EXACTMASS 296.23514489 AVERAGEMASS 296.44488 SMILES CCC=CCCC(O)CC=CCCCCCCCC(O)=O M END