Mol:FL1C1CNP0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 26 29 0 0 0 0 0 0 0 0999 V2000 -1.8620 0.5106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -0.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3057 -0.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7494 -0.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7494 0.5106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3057 0.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1931 -0.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3632 -0.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9193 -0.4528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4754 -0.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0364 -0.4556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5974 -0.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5974 0.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0364 0.8400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4754 0.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1931 -0.9542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3057 -1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4183 0.8318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9746 0.5106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9746 -0.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4183 -0.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5942 0.3446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2135 -0.3319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5942 0.1922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2135 0.7162 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 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 10 1 0 0 0 0 7 16 2 0 0 0 0 3 17 1 0 0 0 0 1 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 2 1 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 12 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 13 1 0 0 0 0 S SKP 8 ID FL1C1CNP0001 KNApSAcK_ID C00007034 NAME Glabrachromene II CAS_RN 51848-09-0 FORMULA C21H18O5 EXACTMASS 350.115423686 AVERAGEMASS 350.36462 SMILES c(c34)cc(cc3OCO4)C=CC(c(c2O)ccc(c21)OC(C=C1)(C)C)=O M END