Mol:FL2FABNM0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 22 24 0 0 0 0 0 0 0 0999 V2000 -2.7923 0.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0743 -1.0315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3621 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3622 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0767 0.6185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6454 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0668 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0656 0.2082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6478 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7822 0.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4957 0.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2101 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4954 1.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6496 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0786 -1.8565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5046 0.6202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8783 1.8300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5046 1.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0767 1.3756 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 14 20 1 0 0 0 0 20 21 1 0 0 0 0 6 22 1 0 0 0 0 S SKP 8 ID FL2FABNM0002 KNApSAcK_ID C00014146 NAME 5,7-Dihydroxy-4'-methoxy-8-methylflavanone CAS_RN 109248-40-0 FORMULA C17H16O5 EXACTMASS 300.099773622 AVERAGEMASS 300.30593999999996 SMILES COc(c3)ccc(c3)C(C1)Oc(c(C)2)c(c(O)cc(O)2)C(=O)1 M END