Mol:FL3FBCNS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 22 24 0 0 0 0 0 0 0 0999 V2000 -1.9630 -0.2105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -0.8529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4067 -1.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8504 -0.8529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8504 -0.2105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4067 0.1107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2941 -1.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2622 -0.8529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2622 -0.2105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2941 0.1107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2941 -1.6749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8183 0.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3853 -0.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9523 0.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9523 0.7652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3853 1.0926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8183 0.7652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5191 0.1106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5191 1.0925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3853 1.7471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8431 -1.3346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1286 -1.7471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 9 12 1 0 0 0 0 12 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 12 1 0 0 0 0 1 18 1 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 3 21 1 0 0 0 0 21 22 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 21 22 M SBL 1 1 23 M SMT 1 OCH3 M SBV 1 23 -4.8497 2.3102 S SKP 8 ID FL3FBCNS0001 KNApSAcK_ID C00003864 NAME Luteolin 5-methyl ether CAS_RN 58115-29-0 FORMULA C16H12O6 EXACTMASS 300.063388116 AVERAGEMASS 300.26288 SMILES COc(c3)c(C(=O)2)c(cc(O)3)OC(=C2)c(c1)cc(O)c(O)c1 M END