Mol:FL3FABGS0014
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 34 0 0 0 0 0 0 0 0999 V2000 -0.7076 -1.0822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0069 -0.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0069 0.1554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7076 0.5679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4221 0.1554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4221 -0.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7214 -1.0822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -0.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 0.1554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7214 0.5679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1677 0.5778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 0.1706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5784 0.5778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5784 1.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 1.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1677 1.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1624 1.7296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9853 1.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7214 -1.7788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7076 -1.7995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2454 0.4817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9745 -0.3008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4306 -1.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5535 -0.8402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6711 -1.0715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2149 -0.2815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -0.5320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 -0.4260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9853 -0.8783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0264 -1.4573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6719 -1.7718 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 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 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 3 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 7 19 2 0 0 0 0 1 20 1 0 0 0 0 5 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 1 0 0 0 25 24 1 1 0 0 0 26 25 1 1 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 21 26 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 31 1 0 0 0 0 S SKP 5 ID FL3FABGS0014 FORMULA C22H22O9 EXACTMASS 430.126382302 AVERAGEMASS 430.40468000000004 SMILES c(c1C(O2)=CC(c(c4O)c(cc(c4)OC(C3O)OC(C(O)C3O)C)2)=O)cc(OC)cc1 M END