Mol:FLIAACNP0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 34 0 0 0 0 0 0 0 0999 V2000 -1.1965 0.5671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1965 -0.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -0.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1956 -0.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1956 0.5671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 0.8560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3049 -0.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8053 -0.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8053 0.5671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3049 0.8560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3049 -0.8769 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3054 -0.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3054 -0.8354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7695 -1.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2337 -0.8354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2337 -0.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7695 -0.0316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -0.8772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7695 -1.6383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6969 -1.1029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 1.4339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1965 1.7228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6969 1.4339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6969 0.8560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2328 1.7433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3403 1.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6966 -0.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6966 -0.8770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1968 -1.1658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6969 -0.8770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1968 -1.7433 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 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 8 12 1 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 17 1 0 0 0 0 17 12 2 0 0 0 0 3 18 1 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 6 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 1 1 0 0 0 0 23 25 1 1 0 0 0 23 26 1 6 0 0 0 2 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 S SKP 8 ID FLIAACNP0001 KNApSAcK_ID C00002562 NAME Pomiferin CAS_RN 572-03-2 FORMULA C25H24O6 EXACTMASS 420.1572885 AVERAGEMASS 420.45446 SMILES c(c(O)4)(cc(cc4)C(=C1)C(c(c3O)c(c(c2c3CC=C(C)C)C=CC(O2)(C)C)O1)=O)O M END