Mol:FL3FEAGS0012
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 40 44 0 0 0 0 0 0 0 0999 V2000 -0.7356 -0.2959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7356 -1.1054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0346 -1.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6664 -1.1054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6664 -0.2959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0346 0.1089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3676 -1.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0687 -1.1054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0687 -0.2959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3676 0.1089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3676 -2.1414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7695 0.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -0.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1984 0.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1984 0.9338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 1.3463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7695 0.9338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4365 0.1088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9128 1.3462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0346 -2.1418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4352 -1.5094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2454 -1.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6845 -2.1738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8766 -1.8596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0971 -1.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6635 -1.2846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4887 -1.5809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9128 -1.7154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3731 -2.1341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3103 -2.2986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9388 0.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2551 -0.1149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4721 0.6439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2551 1.4074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9388 1.8021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7219 1.0431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6457 2.2986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 1.9603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 1.4551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6385 0.2680 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 1 18 1 0 0 0 0 15 19 1 0 0 0 0 20 3 1 0 0 0 0 2 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 21 1 0 0 0 0 32 31 1 1 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 1 0 0 0 36 31 1 1 0 0 0 35 37 1 0 0 0 0 34 38 1 0 0 0 0 36 39 1 0 0 0 0 31 40 1 0 0 0 0 32 18 1 0 0 0 0 S SKP 5 ID FL3FEAGS0012 FORMULA C26H28O14 EXACTMASS 564.147905604 AVERAGEMASS 564.49212 SMILES c(c1)(ccc(C(O2)=CC(c(c(O)3)c2cc(OC(C5O)OC(C)C(C5O)O)c3OC(C4O)OCC(C4O)O)=O)c1)O M END
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