Mol:FL3FA9NCN001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 26 29 0 0 0 0 0 0 0 0999 V2000 -0.3360 -0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -0.2293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 0.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -0.2293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -1.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1119 -1.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5599 -0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5599 -0.2293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1119 0.0293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0077 0.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 0.5463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6118 1.1889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1697 1.5511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6866 1.1325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4483 0.5115 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 0.0709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9876 0.5115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 0.5463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -1.5511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1119 -1.4272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4976 -0.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9876 0.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9876 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4976 0.8779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0077 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 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 2 1 0 0 0 0 9 11 1 0 0 0 0 3 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 12 1 0 0 0 0 4 17 1 0 0 0 0 16 18 1 0 0 0 0 12 19 1 4 0 0 0 6 20 1 0 0 0 0 7 21 2 0 0 0 0 11 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 11 1 0 0 0 0 S SKP 8 ID FL3FA9NCN001 KNApSAcK_ID C00002339 NAME Ficine CAS_RN 2520-36-7 FORMULA C20H19NO4 EXACTMASS 337.131408101 AVERAGEMASS 337.3692 SMILES c(c(O)2)(C(=O)4)c(OC(=C4)c(c3)cccc3)c(c(O)c2)C(C1)(N(CC1)C)[H] M END