Mol:FL5FDKNS0006
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 27 29 0 0 0 0 0 0 0 0999 V2000 -1.0722 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0722 -0.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7867 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5012 -0.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5011 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7867 -1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3577 -1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3568 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3566 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3577 0.2061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0711 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7856 -0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7855 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3577 -2.2689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2156 0.2061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0712 -1.4439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7867 -2.2689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2144 1.4439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7855 2.2689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2133 -0.2054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9289 1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9253 0.2058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9289 -0.2057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7845 -1.0320 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 1 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 2 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 4 18 1 0 0 0 0 8 19 1 0 0 0 0 6 20 1 0 0 0 0 14 21 1 0 0 0 0 15 22 1 0 0 0 0 13 23 1 0 0 0 0 21 24 1 0 0 0 0 23 25 1 0 0 0 0 18 26 1 0 0 0 0 19 27 1 0 0 0 0 S SKP 8 ID FL5FDKNS0006 KNApSAcK_ID C00013371 NAME 5,5'-Dihydroxy-3,7,3',4'-tetramethoxyflavone CAS_RN - FORMULA C19H18O8 EXACTMASS 374.100167552 AVERAGEMASS 374.34142 SMILES c(c(OC)1)(OC)cc(C(O2)=C(C(c(c(O)3)c2cc(OC)c3)=O)OC)cc1O M END