Mol:FL3FACNI0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 26 28 0 0 0 0 0 0 0 0999 V2000 -1.9499 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9499 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3936 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8373 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8373 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3936 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2753 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2753 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -1.7854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8314 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3983 -0.3273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9653 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9653 0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3983 0.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8314 0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3936 -1.9267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3936 0.6425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 0.8326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9497 0.9635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9497 1.6057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3936 1.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5058 1.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3983 1.6365 0.0000 O 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 3 18 1 0 0 0 0 6 19 1 0 0 0 0 20 15 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 1 25 1 0 0 0 0 16 26 1 0 0 0 0 S SKP 8 ID FL3FACNI0001 KNApSAcK_ID C00004034 NAME 5,7,3',4'-Tetrahydroxy-8-prenylflavone CAS_RN 14926-12-6 FORMULA C20H18O6 EXACTMASS 354.110338308 AVERAGEMASS 354.35332 SMILES C(=O)(C=2)c(c1OC2c(c3)cc(c(O)c3)O)c(cc(O)c(CC=C(C)C)1)O M END