Mol:FL5FAAGS0078
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 51 56 0 0 0 0 0 0 0 0999 V2000 1.2824 3.2457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2824 2.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9968 2.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7113 2.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7113 3.2457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9968 3.6582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5678 2.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1467 2.4206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8612 2.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8612 1.1831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1467 0.7706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5678 1.1831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5756 2.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2901 2.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2901 1.1831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5756 0.7706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1467 0.0524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0046 2.4206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3832 0.7272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 3.5926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5756 0.0711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6956 -0.6052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7581 -1.4278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2851 -0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0621 -0.5156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9997 0.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4725 -0.3276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5294 -1.1027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2319 -1.6087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2386 -1.4673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2018 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4561 -2.9943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2548 -3.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6651 -2.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3827 -2.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -1.8714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1736 -2.5873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5442 -2.4964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0929 -2.8714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1336 -3.6582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -3.5702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4578 -2.5426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6738 -2.4267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2613 -3.1412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4632 -2.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -3.1589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0825 -2.4444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8806 -2.6534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -3.5033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9308 -3.0730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -2.6412 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 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 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 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 12 19 1 0 0 0 0 5 20 1 0 0 0 0 16 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 25 28 1 0 0 0 0 24 29 1 0 0 0 0 23 30 1 0 0 0 0 22 31 1 0 0 0 0 26 19 1 0 0 0 0 32 33 1 1 0 0 0 33 34 1 1 0 0 0 35 34 1 1 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 32 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 32 40 1 0 0 0 0 33 41 1 0 0 0 0 34 42 1 0 0 0 0 35 28 1 0 0 0 0 43 44 1 1 0 0 0 44 45 1 1 0 0 0 46 45 1 1 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 43 1 0 0 0 0 45 49 1 0 0 0 0 44 50 1 0 0 0 0 43 51 1 0 0 0 0 46 39 1 0 0 0 0 S SKP 5 ID FL5FAAGS0078 FORMULA C32H38O19 EXACTMASS 726.200729034 AVERAGEMASS 726.6327200000001 SMILES Oc(c6)c(C2=O)c(cc6O)OC(=C2OC(O5)C(C(C(O)C(C)5)O)OC(C4O)OC(C(C4O)O)COC(O3)C(O)C(C(C3)O)O)c(c1)ccc(O)c1 M END