Mol:FL2FACNI0011
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 33 0 0 0 0 0 0 0 0999 V2000 -1.0451 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5242 -1.6245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0033 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0033 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5242 -0.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0451 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5176 -1.6245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0385 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0385 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5176 -0.4216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5588 -0.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5176 -2.1484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0932 -0.7304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6275 -0.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6275 0.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0932 0.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5588 0.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5242 -2.2254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4719 -0.4759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 0.5031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -0.7299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0932 1.1770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6515 1.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6515 2.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0022 2.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1326 2.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6148 -1.6527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1774 -1.3279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6815 -1.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6815 -2.1910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 -1.3422 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 9 11 1 0 0 0 0 7 12 2 0 0 0 0 11 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 11 1 0 0 0 0 2 18 1 0 0 0 0 6 19 1 0 0 0 0 15 20 1 0 0 0 0 14 21 1 0 0 0 0 16 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 1 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 S SKP 8 ID FL2FACNI0011 KNApSAcK_ID C00008544 NAME 5,7,3',4'-Tetrahydroxy-6,5'-di-C-prenylflavanone CAS_RN 156788-69-1 FORMULA C25H28O6 EXACTMASS 424.188588628 AVERAGEMASS 424.48622 SMILES C(=C(C)C)Cc(c(O)1)cc(C(O2)CC(=O)c(c3O)c2cc(O)c3CC=C(C)C)cc1O M END