Mol:FL2FBFNP0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 29 32 0 0 0 0 0 0 0 0999 V2000 -2.5036 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -0.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7078 -0.8643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -0.4632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0388 0.3617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7645 0.7867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2981 -0.8887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3757 -0.4878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3665 0.3786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3174 0.7618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 0.7911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7721 0.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4795 0.7964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5084 1.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7921 2.0577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0718 1.6575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2981 -1.6304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2229 2.0324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7078 -1.6487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8931 1.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1763 0.3941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8855 0.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4321 -2.0668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 1.6577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5647 2.0668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3037 1.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2872 0.7462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7654 2.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8931 1.2646 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 18 14 1 0 0 0 0 3 19 1 0 0 0 0 18 20 1 0 0 0 0 13 21 1 0 0 0 0 21 22 1 0 0 0 0 19 23 1 0 0 0 0 6 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 1 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 S SKP 8 ID FL2FBFNP0001 KNApSAcK_ID C00014243 NAME Glyflavanone B;(2S)-5,3',4'-Trimethyoxy-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone CAS_RN 167568-53-8 FORMULA C23H24O6 EXACTMASS 396.1572885 AVERAGEMASS 396.43306 SMILES c(c1)(c(OC)cc(C(O2)CC(=O)c(c4OC)c2c(c(c4)3)C=CC(O3)(C)C)c1)OC M END