Mol:FL3FEAGS0047
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 35 38 0 0 0 0 0 0 0 0999 V2000 -0.6990 0.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -0.7566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0155 -1.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7299 -0.7566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7299 0.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0155 0.4809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4444 -1.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1589 -0.7566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1589 0.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4444 0.4809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8733 0.4809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5878 0.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3023 0.4809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3023 1.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5878 1.7184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8733 1.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4444 -1.9941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0155 -1.9941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0486 1.7367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4186 0.4153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -1.1532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0962 -0.7432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 0.9104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8854 0.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 0.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2936 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7061 0.8927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5045 0.6836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8904 1.2752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0486 0.7093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6262 0.3942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7335 -0.2074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5185 1.9192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6329 1.2752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0479 1.9941 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 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 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 3 18 1 0 0 0 0 14 19 1 0 0 0 0 20 1 1 0 0 0 0 2 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 1 0 0 0 24 25 1 1 0 0 0 26 25 1 1 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 23 1 0 0 0 0 28 29 1 0 0 0 0 23 30 1 0 0 0 0 24 31 1 0 0 0 0 25 32 1 0 0 0 0 29 33 2 0 0 0 0 29 34 1 0 0 0 0 26 20 1 0 0 0 0 34 35 1 0 0 0 0 S SKP 5 ID FL3FEAGS0047 FORMULA C23H22O12 EXACTMASS 490.111126168 AVERAGEMASS 490.41358 SMILES O=C(C(O1)C(O)C(O)C(O)C(Oc(c2)c(OC)c(O)c(C(=O)3)c2OC(c(c4)ccc(c4)O)=C3)1)OC M END