Mol:FL2FEGNS0005
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 29 31 0 0 0 0 0 0 0 0999 V2000 -2.5006 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2151 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2151 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9296 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9296 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9296 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 2.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 -2.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9296 0.2063 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 1 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 1 19 1 0 0 0 0 2 20 1 0 0 0 0 20 21 1 0 0 0 0 19 22 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 24 25 1 0 0 0 0 15 26 1 0 0 0 0 26 27 1 0 0 0 0 18 28 1 0 0 0 0 23 29 1 0 0 0 0 S SKP 8 ID FL2FEGNS0005 KNApSAcK_ID C00014141 NAME 5,6,7,3',4',5'-Hexamethoxyflavanone CAS_RN 74064-17-8 FORMULA C21H24O8 EXACTMASS 404.14711774399996 AVERAGEMASS 404.41046 SMILES c(C(=O)1)(c3OC)c(cc(c3OC)OC)OC(c(c2)cc(OC)c(OC)c2OC)C1 M END