Mol:FL2FACNI0010
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 27 29 0 0 0 0 0 0 0 0999 V2000 -1.0635 -0.6740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5426 -0.9748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0217 -0.6740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0217 -0.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5426 0.2282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0635 -0.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4992 -0.9748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -0.6740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -0.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4992 0.2282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5404 0.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4992 -1.4987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0748 -0.0806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6091 0.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6091 0.8449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0748 1.1534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5404 0.8449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5426 -1.5756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1426 1.1529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5839 0.2279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0748 1.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5839 -0.9745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1042 -0.6740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6234 -0.9738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1426 -0.6740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1016 -1.4519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4102 -1.7694 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 3 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 4 1 0 0 0 0 9 11 1 0 0 0 0 7 12 2 0 0 0 0 11 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 11 1 0 0 0 0 2 18 1 0 0 0 0 15 19 1 0 0 0 0 6 20 1 0 0 0 0 16 21 1 0 0 0 0 1 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 S SKP 8 ID FL2FACNI0010 KNApSAcK_ID C00008509 NAME 6-C-(3-Hydroxyisopentyl)eriodictyol CAS_RN 151716-83-5 FORMULA C20H22O7 EXACTMASS 374.136553058 AVERAGEMASS 374.38448000000005 SMILES C(=O)(C1)c(c3O)c(cc(c(CCC(C)(C)O)3)O)OC1c(c2)cc(c(O)c2)O M END