Mol:FLIAAANP0006
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 30 33 0 0 0 0 0 0 0 0999 V2000 -2.6490 0.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0927 -0.3385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5364 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5364 0.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0927 0.9463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9801 -0.3385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4238 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4238 0.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9801 0.9463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1323 -0.3384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1323 -1.0252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7271 -1.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3219 -1.0252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3219 -0.3384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7271 0.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9161 -1.3682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2053 0.9463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7616 0.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7616 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2053 -0.3385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7616 1.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 0.3217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0927 -0.9806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5091 -1.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1021 -1.3682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6951 -1.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6951 -0.3425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -1.3675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9801 -0.9806 0.0000 O 0 0 0 0 0 0 0 0 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 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 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 11 2 0 0 0 0 1 2 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 2 1 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 3 24 1 0 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 7 30 2 0 0 0 0 S SKP 8 ID FLIAAANP0006 KNApSAcK_ID C00009836 NAME 4'-O-Prenylalpinumisoflavone CAS_RN 85985-76-8 FORMULA C25H24O5 EXACTMASS 404.162373878 AVERAGEMASS 404.45506 SMILES C(c(c4)ccc(c4)OCC=C(C)C)(C3=O)=COc(c31)cc(O2)c(C=CC2(C)C)c(O)1 M END