Mol:FL3FECNS0018
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 25 29 0 0 0 0 0 0 0 0999 V2000 -2.0021 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0021 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4458 -0.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8895 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8895 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4458 0.4991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3332 -0.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2231 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2231 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3332 0.4991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3332 -1.2864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7792 0.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3462 0.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9131 0.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9131 1.1537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3462 1.4811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7792 1.1537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5198 0.3365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8619 0.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4666 1.3513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4795 -0.8942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2182 -1.4811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5794 -1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 0.5481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8619 0.7617 0.0000 C 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 14 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 15 1 0 0 0 0 2 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 3 1 0 0 0 0 1 24 1 0 0 0 0 24 25 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 24 25 M SBL 1 1 28 M SMT 1 ^OCH3 M SBV 1 28 -6.6809 3.4769 S SKP 8 ID FL3FECNS0018 KNApSAcK_ID C00003998 NAME 7-Methoxy-5,6:3',4'-bis(methylenedioxy)flavone CAS_RN 97640-84-1 FORMULA C18H12O7 EXACTMASS 340.058302738 AVERAGEMASS 340.28368 SMILES c(c2OC)c(O3)c(C(=O)C=C3c(c5)cc(c4c5)OCO4)c(c21)OCO1 M END