Mol:FL5FAAGS0011
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 30 33 0 0 0 0 0 0 0 0999 V2000 -0.5353 0.1943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5353 -0.6306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1791 -1.0431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8934 -0.6306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8934 0.1943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1791 0.6068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6078 -1.0431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3223 -0.6306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3223 0.1943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6078 0.6068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6078 -1.6862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0363 0.6065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7644 0.1862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4925 0.6065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4925 1.4472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7644 1.8676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0363 1.4472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1791 -1.8676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2494 0.6065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2203 1.8675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8769 -1.1349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5961 0.7418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -0.1322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9806 0.2386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0605 0.2484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 0.9172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5632 0.4769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2203 0.4141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6967 -0.1220 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -0.3293 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 FL5FAAGS0011 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