Mol:FL3FEAGS0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 30 33 0 0 0 0 0 0 0 0999 V2000 -0.1322 0.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1322 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5689 -0.9593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2703 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2703 0.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5689 0.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9716 -0.9593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6728 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6728 0.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9716 0.6600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9716 -1.5906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3737 0.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0886 0.2472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8033 0.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8033 1.4852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0886 1.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3737 1.4852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8332 0.6598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5178 1.8977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5689 -1.5911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9337 -0.7949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8234 -0.7543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0216 -1.8127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8673 -1.3636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7535 -1.3516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5629 -0.5421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5727 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5178 -1.1298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8766 -1.7731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9983 -1.8979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 12 1 0 0 0 0 1 18 1 0 0 0 0 15 19 1 0 0 0 0 20 3 1 0 0 0 0 2 21 1 0 0 0 0 22 23 1 1 0 0 0 23 24 1 1 0 0 0 25 24 1 1 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 22 28 1 0 0 0 0 23 29 1 0 0 0 0 24 30 1 0 0 0 0 25 21 1 0 0 0 0 S SKP 5 ID FL3FEAGS0002 FORMULA C20H18O10 EXACTMASS 418.089996796 AVERAGEMASS 418.35092 SMILES C(=O)(C=1)c(c3O)c(cc(O)c3OC(O4)C(O)C(C(O)C4)O)OC1c(c2)ccc(O)c2 M END