Mol:FL5F4GGS0001
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 46 50 0 0 0 0 0 0 0 0999 V2000 3.4746 -0.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7602 0.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7602 1.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4746 1.4435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1891 1.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1891 0.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0457 -0.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3313 0.2060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6168 -0.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6168 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3313 -1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0457 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0976 0.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -0.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0976 -1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3313 -2.1508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5265 0.2060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8213 -1.5235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9035 1.4435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0976 0.9026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9061 -0.2080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4748 -1.4140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4746 2.1230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1491 2.5124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3212 0.6347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9086 -0.0800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1102 0.1291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3167 -0.0977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7293 0.6170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5277 0.4079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8483 0.9099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4725 0.9188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9061 0.3976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5414 0.0126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5791 -0.5121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0325 -1.2204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4451 -1.9351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6516 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8534 -1.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4407 -1.2029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2341 -1.4296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7961 -2.5124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1675 -2.3082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8964 -1.6745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6446 -1.3844 0.0000 C 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 13 21 1 0 0 0 0 6 22 1 0 0 0 0 15 23 1 0 0 0 0 4 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 1 0 0 0 27 28 1 1 0 0 0 29 28 1 1 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 26 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 26 34 1 0 0 0 0 27 35 1 0 0 0 0 28 36 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 1 0 0 0 40 39 1 1 0 0 0 41 40 1 1 0 0 0 41 42 1 0 0 0 0 42 37 1 0 0 0 0 40 43 1 0 0 0 0 39 44 1 0 0 0 0 38 45 1 0 0 0 0 37 46 1 0 0 0 0 41 36 1 0 0 0 0 29 18 1 0 0 0 0 S SKP 5 ID FL5F4GGS0001 FORMULA C28H32O18 EXACTMASS 656.1588642199999 AVERAGEMASS 656.54288 SMILES C(O)(C(CO)2)C(O)C(C(Oc(c(O)3)c(cc(C(=O)5)c3OC(=C5O)c(c4)cc(OC)c(c4O)O)O)O2)OC(C1O)OC(C)C(C1O)O M END
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