Mol:FL3FGGNS0012
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 29 31 0 0 0 0 0 0 0 0999 V2000 -1.0717 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7861 0.0746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 -0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7861 -1.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -1.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3573 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -0.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 0.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 0.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -0.3377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 0.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 0.8998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7861 1.3123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 0.8998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -2.4004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 -0.3377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7861 -2.4004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2151 0.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7861 0.8996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 1.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2151 -1.5754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9295 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1632 1.2823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9284 -0.3372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9295 0.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7861 2.0381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1586 2.4004 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 13 18 1 0 0 0 0 6 19 1 0 0 0 0 4 20 1 0 0 0 0 3 21 1 0 0 0 0 21 22 1 0 0 0 0 5 23 1 0 0 0 0 23 24 1 0 0 0 0 14 25 1 0 0 0 0 20 26 1 0 0 0 0 18 27 1 0 0 0 0 15 28 1 0 0 0 0 28 29 1 0 0 0 0 S SKP 8 ID FL3FGGNS0012 KNApSAcK_ID C00013347 NAME 5,4'-Dihydroxy-6,7,8,3',5'-pentamethoxyflavone;5-Hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-6,7,8-trimethoxy-4H-1-benzopyran-4-one CAS_RN 240804-39-1 FORMULA C20H20O9 EXACTMASS 404.11073223799997 AVERAGEMASS 404.3674 SMILES O(C)c(c31)c(c(c(c(C(=O)C=C(O3)c(c2)cc(OC)c(O)c2OC)1)O)OC)OC M END