Mol:FL3FRNNP0006
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 37 41 0 0 0 0 0 0 0 0999 V2000 0.7355 -1.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0287 -0.8825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4574 -0.9087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4726 -0.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7658 0.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0439 -0.0576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1642 -1.3343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1945 0.3154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2097 1.1403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5029 1.5659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 1.1665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6932 -1.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7083 -2.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0016 -2.5322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7204 -2.1329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9013 -0.1101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9316 1.5396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9467 2.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6687 2.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3754 2.3382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6838 3.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 2.3907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0002 -3.2086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6581 -3.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5135 -3.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -0.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1219 -1.2556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -2.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4303 -2.5060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8287 -0.8300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5506 -1.2293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5657 -2.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8590 -2.4797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3848 -0.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4454 -3.3308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3754 -1.8960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8621 -2.8241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 2 1 0 0 0 0 3 7 2 0 0 0 0 4 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 5 2 0 0 0 0 2 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 8 16 1 0 0 0 0 9 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 10 22 1 0 0 0 0 14 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 12 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 13 1 0 0 0 0 27 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 28 1 0 0 0 0 26 34 1 0 0 0 0 29 35 1 0 0 0 0 32 36 1 0 0 0 0 32 37 1 0 0 0 0 S SKP 8 ID FL3FRNNP0006 KNApSAcK_ID C00013491 NAME Artonin N;6,7-Dihydro-5,9,11,14-tetrahydroxy-3,3-dimethyl-10-(3-methyl-2-butenyl)-6-(1-methylethenyl)-3H,8H-[1]benzopyrano[7,6-c]xanthen-8-one CAS_RN 151606-36-9 FORMULA C30H30O7 EXACTMASS 502.199153314 AVERAGEMASS 502.55500000000006 SMILES c(O)(c(CC=C(C)C)1)c(C(=O)2)c(OC(c35)=C2CC(C(C)=C)c(c(O)c(O4)c(c(O)5)C=CC(C)(C)4)3)cc(O)1 M END