Mol:FL5FELNS0018
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 30 32 0 0 0 0 0 0 0 0999 V2000 -1.0715 -1.2378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0715 -0.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5005 -0.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5005 -1.2378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -1.6503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -1.6502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3575 -1.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3571 -0.0003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -0.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5005 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5005 0.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 1.2378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0716 0.8252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -2.4752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -0.0003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0719 -1.6501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 1.2378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9295 0.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -2.4753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -1.6503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9294 -1.2378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 2.0628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0716 2.4753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -1.2373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5007 -1.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0719 -2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9295 -0.4128 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 1 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 2 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 4 18 1 0 0 0 0 8 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 5 23 1 0 0 0 0 23 24 1 0 0 0 0 15 25 1 0 0 0 0 25 26 1 0 0 0 0 12 27 1 0 0 0 0 27 28 1 0 0 0 0 19 29 1 0 0 0 0 18 30 1 0 0 0 0 S SKP 8 ID FL5FELNS0018 KNApSAcK_ID C00013379 NAME 5-Hydroxy-3,6,7,2',4',5'-hexamethoxyflavone;5-Hydroxy-3,6,7-trimethoxy-2-(2,4,5-trimethoxyphenyl)-4H-1-benzopyran-4-one CAS_RN 80496-66-8 FORMULA C21H22O9 EXACTMASS 418.126382302 AVERAGEMASS 418.39398 SMILES COc(c3OC)cc(O1)c(c3O)C(C(=C1c(c2OC)cc(OC)c(c2)OC)OC)=O M END