Mol:FLIAACNP0007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 34 0 0 0 0 0 0 0 0999 V2000 -2.0422 1.1793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0422 0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4859 0.2157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9296 0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9296 1.1793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4859 1.5005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3732 0.2157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1831 0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1831 1.1793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3732 1.5005 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7391 0.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7391 -0.4709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3339 -0.8143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9287 -0.4709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9287 0.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3339 0.5593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3732 -0.4264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5983 0.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5983 1.5003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4859 -0.4264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5229 -0.8140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5983 -0.4249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1532 -0.7453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1532 -1.3860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7081 -0.4249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1183 -0.4709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1183 0.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5235 0.5593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1183 -1.1723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7081 -0.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3339 -1.5005 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 7 17 2 0 0 0 0 2 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 14 21 1 0 0 0 0 18 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 21 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 15 1 0 0 0 0 26 29 1 0 0 0 0 26 30 1 0 0 0 0 13 31 1 0 0 0 0 S SKP 8 ID FLIAACNP0007 KNApSAcK_ID C00009923 NAME Gancaonin H;5,7,3'-Trihydroxy-6-prenyl-6'',6''-dimethylpyrano[2'',3'':4',5']isoflavone CAS_RN 126716-35-6 FORMULA C25H24O6 EXACTMASS 420.1572885 AVERAGEMASS 420.45446 SMILES Oc(c14)c(CC=C(C)C)c(cc(OC=C(C(=O)4)c(c3)cc(c2c3O)C=CC(O2)(C)C)1)O M END