Mol:FL1CDCNS0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 25 27 0 0 0 0 0 0 0 0999 V2000 -2.4695 0.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4677 -0.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7523 -0.6277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0388 -0.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0388 0.6113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7559 1.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3243 -0.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3243 -1.4512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3902 -0.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1047 -0.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8191 -0.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5333 -0.6564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2563 -0.2591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2738 0.5657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5682 0.9932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8452 0.5959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3243 1.0238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 1.0207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8984 0.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7523 -1.4527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4668 -1.8652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3243 1.8488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8984 1.1046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5789 1.8652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7568 1.7964 0.0000 O 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 4 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 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 5 17 1 0 0 0 0 1 18 1 0 0 0 0 18 19 1 0 0 0 0 3 20 1 0 0 0 0 20 21 1 0 0 0 0 17 22 1 0 0 0 0 14 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 15 1 0 0 0 0 S SKP 8 ID FL1CDCNS0002 KNApSAcK_ID C00014431 NAME 3,4-Methylenedioxy-2',4',6'-trimethoxychalcone CAS_RN 151703-88-7 FORMULA C19H18O6 EXACTMASS 342.110338308 AVERAGEMASS 342.34262 SMILES c(O3)(c1)c(OC3)ccc(C=CC(c(c(OC)2)c(OC)cc(OC)c2)=O)1 M END