Mol:FL2F1AGS0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 39 43 0 0 0 0 0 0 0 0999 V2000 -1.8307 0.1853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 0.6010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8275 -0.6397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1107 -1.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3981 -0.6334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4018 0.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3182 -1.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0308 -0.6271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0272 0.1980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3109 0.6073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6809 0.5788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3969 0.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1098 0.5844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1066 1.4094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3905 1.8191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6778 1.4038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3193 -1.6860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6709 0.6194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8139 1.8177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8001 -1.1847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4457 -0.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1204 0.0880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 0.9063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5813 0.3922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9066 -0.3663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4550 -0.7955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4187 -1.4362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8767 -1.8191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2987 -1.5047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7124 0.7879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2344 -0.4831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2344 -1.0261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0502 -1.0672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2182 0.2558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6824 -0.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5996 -0.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0502 -0.4831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6404 0.1356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7124 0.5411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 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 2 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 6 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 7 17 2 0 0 0 0 1 18 1 0 0 0 0 14 19 1 0 0 0 0 20 21 1 1 0 0 0 21 22 1 1 0 0 0 23 22 1 1 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 20 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 20 28 1 0 0 0 0 21 29 1 0 0 0 0 22 30 1 0 0 0 0 23 19 1 0 0 0 0 37 31 1 1 0 0 0 36 31 1 1 0 0 0 35 37 1 1 0 0 0 31 32 1 0 0 0 0 37 33 1 0 0 0 0 38 35 1 0 0 0 0 34 39 1 0 0 0 0 36 38 1 0 0 0 0 31 34 1 0 0 0 0 18 35 1 0 0 0 0 S SKP 5 ID FL2F1AGS0004 FORMULA C26H30O13 EXACTMASS 550.168641046 AVERAGEMASS 550.5086 SMILES OC(C5CO)C(O)C(C(O5)Oc(c1)ccc(C(C4)Oc(c2)c(C4=O)ccc2OC(C(O)3)OCC(O)3CO)c1)O M END