Mol:FL64A9NP0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 26 29 0 0 0 0 0 0 0 0999 V2000 1.3486 0.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 0.8314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0726 0.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0726 -0.3994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -0.8096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3486 -0.3994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7832 0.8314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4938 0.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4938 -0.3994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7832 -0.8096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1304 0.7888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0592 -0.8096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7698 -0.3994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7698 0.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0592 0.8314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3921 0.7804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5218 -0.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1304 1.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8261 1.9937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5218 1.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5218 0.7888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8261 0.3871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -1.5812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3525 -1.9937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7997 -1.5777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5141 -1.9902 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 3 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 4 1 0 0 0 0 5 23 1 0 0 0 0 8 11 1 1 0 0 0 10 25 1 0 0 0 0 6 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 1 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 11 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 11 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 S SKP 8 ID FL64A9NP0003 KNApSAcK_ID C00013267 NAME Xuulanin;2H,(6R,8S)-rel-7,8-Dihydro-5,6-dimethoxy-2,2-dimethyl-8-phenyl-6H-benzo[1,2-b:5,4-b']dipyran CAS_RN 299410-78-9 FORMULA C22H24O4 EXACTMASS 352.167459256 AVERAGEMASS 352.42356 SMILES c(c4)(cccc4)C(O1)CC(c(c2OC)c1cc(O3)c(C=CC3(C)C)2)OC M END