Mol:FL1D19NS0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 19 20 0 0 0 0 0 0 0 0999 V2000 -1.8587 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8587 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1442 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4297 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4297 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1442 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3303 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0286 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3303 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0286 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7447 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4592 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1736 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1736 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4592 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7447 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1707 0.5038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5042 0.5298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1736 0.1433 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 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 18 19 1 0 0 0 0 S SKP 8 ID FL1D19NS0002 KNApSAcK_ID C00014591 NAME 2'-Hydroxy-4'-methoxydihydrochalcone;2'-Hydroxy-4'-methoxy-3-phenylpropiophenone CAS_RN 22141-31-7 FORMULA C16H16O3 EXACTMASS 256.109944378 AVERAGEMASS 256.29643999999996 SMILES COc(c2)cc(O)c(c2)C(=O)CCc(c1)cccc1 M END