Mol:FL2FAANP0017
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 34 0 0 0 0 0 0 0 0999 V2000 -1.8157 -0.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7971 -1.1172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0199 -1.5024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3651 -1.1014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3509 -0.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0766 0.1486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3898 -1.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0636 -1.1259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0544 -0.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3705 0.1237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7689 0.1530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -0.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1674 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1963 0.9818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 1.4195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7597 1.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3898 -2.2686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0199 -2.3509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7686 1.3122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5211 0.0724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2079 -0.3456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1893 -1.1494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4839 -1.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0766 0.8841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8616 1.3374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7413 0.1878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7686 -0.6693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 0.9798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8616 2.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2636 2.3509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4145 2.3248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 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 1 2 0 0 0 0 4 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 5 1 0 0 0 0 9 11 1 6 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 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 7 17 2 0 0 0 0 3 18 1 0 0 0 0 14 19 1 0 0 0 0 1 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 2 1 0 0 0 0 6 24 1 0 0 0 0 24 25 1 0 0 0 0 21 26 1 0 0 0 0 21 27 1 0 0 0 0 25 28 1 0 0 0 0 25 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 S SKP 8 ID FL2FAANP0017 KNApSAcK_ID C00014250 NAME Dereticulatin;5,4'-Dihydroxy-8-(2-hydroxy-3-methylbutyl-3-enyl)-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone CAS_RN 193551-72-3 FORMULA C25H26O6 EXACTMASS 422.172938564 AVERAGEMASS 422.47033999999996 SMILES C(C=1)(C)(C)Oc(c4CC(C(C)=C)O)c(c(O)c(c43)C(=O)CC(O3)c(c2)ccc(c2)O)C1 M END