Mol:FL5FACNP0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 28 31 0 0 0 0 0 0 0 0999 V2000 -1.6848 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6848 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1285 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5722 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5722 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1285 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0159 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5404 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5404 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0159 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0159 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0965 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6634 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2304 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2304 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6634 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0965 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0965 -1.1394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7972 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6634 1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1285 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1285 0.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6848 1.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2411 0.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2411 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7972 1.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2411 1.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6818 1.2343 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 8 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 6 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 1 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 22 28 1 4 0 0 0 S SKP 8 ID FL5FACNP0001 KNApSAcK_ID C00005081 NAME 4'',5''-Dihydro-3,5,3',4'-tetrahydroxy-4'',6'',6''-trimethylpyrano[2,3:7,8]flavone CAS_RN 52617-83-1 FORMULA C21H20O7 EXACTMASS 384.120902994 AVERAGEMASS 384.37929999999994 SMILES C(C)(C)(C4)Oc(c(C(C)4)3)cc(c(c13)C(C(O)=C(c(c2)cc(c(O)c2)O)O1)=O)O M END