Mol:FL1ABENM0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 24 26 0 0 0 0 0 0 0 0999 V2000 -3.1710 0.9540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 0.1290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4565 -0.2835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4565 1.3665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7421 0.1290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7421 0.9540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0278 1.3680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3117 0.9532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3123 0.1289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2711 -0.4545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4028 1.3657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1175 0.9530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1175 0.1276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 -0.2848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5464 0.1279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5462 0.9528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8317 1.3652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8855 1.3665 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 -1.1098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4565 -0.9767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1342 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2845 -0.2983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8855 0.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -0.2717 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 5 2 0 0 0 0 6 4 2 0 0 0 0 4 1 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 5 9 1 0 0 0 0 9 10 2 0 0 0 0 8 11 2 0 0 0 0 11 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 14 19 1 0 0 0 0 3 20 1 0 0 0 0 20 21 1 0 0 0 0 15 22 1 0 0 0 0 22 23 1 0 0 0 0 2 24 1 0 0 0 0 S SKP 8 ID FL1ABENM0001 KNApSAcK_ID C00014656 NAME 6,3'-Dihydroxy-4,4'-dimethoxy-5-methylaurone CAS_RN 193552-54-4 FORMULA C18H16O6 EXACTMASS 328.094688244 AVERAGEMASS 328.31604 SMILES o(c2=Cc(c3)cc(O)c(OC)c3)c(c1c2=O)cc(c(c1OC)C)O M END