Mol:FL5FACNI0005
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 32 34 0 0 0 0 0 0 0 0999 V2000 -1.0760 -1.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0858 -0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3642 -1.4382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3505 -1.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3424 -0.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3762 0.2119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7704 -0.1898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0569 0.2217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7975 0.1952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5131 -0.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5031 -1.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7894 -1.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4833 0.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4469 1.1116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7131 1.4946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0385 1.0609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7894 -2.2800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3642 -2.2632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -1.4337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2276 0.1895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1614 1.5241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2175 -1.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7131 2.3192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1977 -0.1485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9219 0.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6207 -0.1339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6207 -0.9372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3538 0.2893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9295 -1.0554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6561 -1.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6561 -2.3192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3538 -1.0721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 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 2 1 0 0 0 0 7 8 1 0 0 0 0 8 5 1 0 0 0 0 2 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 1 2 0 0 0 0 7 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 8 2 0 0 0 0 12 17 1 0 0 0 0 3 18 2 0 0 0 0 4 19 1 0 0 0 0 10 20 1 0 0 0 0 21 14 1 0 0 0 0 11 22 1 0 0 0 0 15 23 1 0 0 0 0 13 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 22 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 S SKP 8 ID FL5FACNI0005 KNApSAcK_ID C00013522 NAME Broussonol E;Papyriflavonol A;2-[3,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-3,5,7-trihydroxy-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one CAS_RN 363134-28-5 FORMULA C25H26O7 EXACTMASS 438.167853186 AVERAGEMASS 438.46974 SMILES c(c1)(c(c(cc(C(=C(O)3)Oc(c2C(=O)3)cc(O)c(c(O)2)CC=C(C)C)1)O)O)CC=C(C)C M END