Mol:FL3FA9NR0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 29 32 0 0 0 0 0 0 0 0999 V2000 0.3566 -0.0004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3566 0.8246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3578 1.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3578 -0.4129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0711 -0.4129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7856 -0.0004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7856 0.8247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0711 1.2371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5001 1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2145 0.8247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 2.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2145 2.4747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 2.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0711 -1.0136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0723 -0.0004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0723 0.8246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3578 -1.2379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7868 1.2371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7856 -0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 0.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2145 -0.4122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2145 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -1.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7856 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 -1.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -2.4747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0711 -1.6497 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 17 2 0 0 0 0 16 4 2 0 0 0 0 4 1 1 0 0 0 0 1 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 2 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 10 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 9 1 0 0 0 0 5 15 2 0 0 0 0 17 16 1 0 0 0 0 4 18 1 0 0 0 0 17 19 1 0 0 0 0 16 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 20 1 0 0 0 0 24 27 1 0 0 0 0 25 28 1 0 0 0 0 26 29 2 0 0 0 0 S SKP 8 ID FL3FA9NR0001 KNApSAcK_ID C00013462 NAME Hosloppin;5-Hydroxy-6-(5-hydroxy-6-methyl-4-oxo-4H-pyran-3-yl)-7-methoxy-2-phenyl-4H-1-benzopyran-4-one CAS_RN 163597-62-4 FORMULA C22H16O7 EXACTMASS 392.089602866 AVERAGEMASS 392.35824 SMILES c(c3)(c2c(c(C(=C4)C(=O)C(O)=C(O4)C)c3OC)O)OC(=CC(=O)2)c(c1)cccc1 M END