Mol:FL2FALNI0027
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 33 0 0 0 0 0 0 0 0999 V2000 -1.4019 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -0.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3602 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3602 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 0.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4019 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1607 -0.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6816 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6816 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1607 0.4393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 0.4390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1607 -1.2876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7363 0.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2707 0.4390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2707 1.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7363 1.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 1.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -1.3645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8288 0.3850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8042 1.3640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9716 -0.7918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5342 -0.4670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0384 -0.7581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0384 -1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5179 -0.4813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7463 1.3191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9625 0.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5179 0.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9625 -0.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5072 -0.2749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3964 -0.7376 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 1 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 17 26 1 0 0 0 0 14 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 29 31 2 0 0 0 0 S SKP 8 ID FL2FALNI0027 KNApSAcK_ID C00008545 NAME 2'4'-Dihydroxy-5'-(1'',1''-dimethylallyl)-6-C-prenylpinocembrin CAS_RN 157072-26-9 FORMULA C25H28O6 EXACTMASS 424.188588628 AVERAGEMASS 424.48622 SMILES Oc(c3C(C)(C)C=C)cc(O)c(c3)C(C1)Oc(c2)c(c(c(CC=C(C)C)c2O)O)C(=O)1 M END