Mol:FL2FFCNS0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 23 25 0 0 0 0 0 0 0 0999 V2000 -2.8633 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8633 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1489 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4344 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4344 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1489 0.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7199 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0055 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0055 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7199 0.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4675 0.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4675 1.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7199 -1.8191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1489 -1.8198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8002 0.2254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8706 1.8049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5244 1.4274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5244 0.5261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1489 1.1710 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 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 6 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 13 19 1 0 0 0 0 14 20 1 0 0 0 0 20 21 1 0 0 0 0 1 22 1 0 0 0 0 6 23 1 0 0 0 0 S SKP 8 ID FL2FFCNS0004 KNApSAcK_ID C00014132 NAME 8-Hydroxyhesperetin;5,7,8,3'-Tetrahydroxy-4'-methoxyflavanone CAS_RN 460090-60-2 FORMULA C16H14O7 EXACTMASS 318.073952802 AVERAGEMASS 318.27816 SMILES COc(c3)c(O)cc(c3)C(C1)Oc(c(O)2)c(c(O)cc(O)2)C(=O)1 M END