Mol:FL5FAAGS0010
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 30 33 0 0 0 0 0 0 0 0999 V2000 -0.8041 0.1932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8041 -0.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0937 -1.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6168 -0.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6168 0.1932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0937 0.6034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3272 -1.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0376 -0.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0376 0.1932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3272 0.6034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3272 -1.6769 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7478 0.6032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4719 0.1852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 0.6032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 1.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4719 1.8574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7478 1.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0937 -1.8574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5143 0.6032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9198 1.8572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5893 -1.1287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8007 0.7178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1422 -0.1514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 0.2173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 0.2271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9439 0.8922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7734 0.4543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5871 1.5147 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9198 -0.1203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3812 -0.2837 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 3 18 1 0 0 0 0 1 19 1 0 0 0 0 15 20 1 0 0 0 0 8 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 19 1 0 0 0 0 S SKP 5 ID FL5FAAGS0010 FORMULA C20H18O10 EXACTMASS 418.089996796 AVERAGEMASS 418.35092 SMILES c(c4)c(ccc(O)4)C(=C3O)Oc(c1)c(C3=O)c(cc(OC(O2)C(O)C(C(O)C2)O)1)O M END