Mol:FL3FA9NP0007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 30 34 0 0 0 0 0 0 0 0999 V2000 -0.5851 -1.1254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5851 -0.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2995 0.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2995 -1.5379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1294 -1.5379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8439 -1.1254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8439 -0.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1294 0.1121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5584 0.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2728 -0.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9873 0.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9873 0.9371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2728 1.3496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5583 0.9371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1294 -2.2054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -1.1254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -0.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4711 0.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2915 1.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6271 0.2516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1355 1.6727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7486 2.2248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4631 1.8123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1117 2.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 2.6504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9873 1.0053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7559 0.9190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4457 1.6727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2995 -2.2379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -2.6504 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 17 2 0 0 0 0 16 4 2 0 0 0 0 4 1 1 0 0 0 0 1 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 2 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 10 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 9 1 0 0 0 0 5 15 2 0 0 0 0 17 16 1 0 0 0 0 3 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 17 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 19 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 21 28 1 6 0 0 0 19 26 1 6 0 0 0 18 27 1 6 0 0 0 4 29 1 0 0 0 0 29 30 1 0 0 0 0 S SKP 8 ID FL3FA9NP0007 KNApSAcK_ID C00013470 NAME Multijuginol;(7aR,10S,10aS)-rel-(+)-7a,9,10,10a-Tetrahydro-10-hydroxy-5-methoxy-9,9-dimethyl-2-phenyl-4H-furo[3',2':4,5]furo[2,3-h]-1-benzopyran-4-one CAS_RN 58276-83-8 FORMULA C22H20O6 EXACTMASS 380.125988372 AVERAGEMASS 380.3906 SMILES C(O5)([H])(O1)C([H])(C(C(C)(C)5)O)c(c42)c1cc(c2C(C=C(O4)c(c3)cccc3)=O)OC M END