Mol:FL6FAANS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 19 21 0 0 0 0 0 0 0 0999 V2000 -1.9630 0.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -0.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4067 -0.8414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8504 -0.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8504 0.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4067 0.4433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2941 -0.8414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2622 -0.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2622 0.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2941 0.4433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8183 0.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3853 0.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9523 0.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9523 1.0979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3853 1.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8183 1.0979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5191 0.4432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5191 1.4251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4067 -1.4252 0.0000 O 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 1 17 1 0 0 0 0 14 18 1 0 0 0 0 3 19 1 0 0 0 0 S SKP 8 ID FL6FAANS0001 KNApSAcK_ID C00008753 NAME Apigeniflavan CAS_RN 530-82-5 FORMULA C15H14O4 EXACTMASS 258.089208936 AVERAGEMASS 258.26926000000003 SMILES Oc(c3)ccc(c3)C(C2)Oc(c1)c(C2)c(O)cc(O)1 M END