Mol:FL1D1ANS0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 21 22 0 0 0 0 0 0 0 0999 V2000 -2.2047 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2047 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4902 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7757 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7757 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4902 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0157 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6826 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0157 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6826 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3987 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1132 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8276 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8276 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1132 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3987 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1636 0.5105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8504 0.5299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1636 1.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4601 0.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4601 1.7283 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 7 9 2 0 0 0 0 8 10 1 0 0 0 0 10 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 5 17 1 0 0 0 0 1 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 14 21 1 0 0 0 0 S SKP 8 ID FL1D1ANS0003 KNApSAcK_ID C00014595 NAME 4-Hydroxy-2',4'-dimethoxydihydrochalcone CAS_RN 307500-80-7 FORMULA C17H18O4 EXACTMASS 286.120509064 AVERAGEMASS 286.32241999999997 SMILES COc(c2)cc(OC)c(c2)C(=O)CCc(c1)ccc(O)c1 M END