Mol:FL1CHYNI0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 25 26 0 0 0 0 0 0 0 0999 V2000 -1.6765 1.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6765 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1202 0.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5639 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5639 1.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1202 1.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0076 0.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5487 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1048 0.1557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6609 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2219 0.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7829 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7829 1.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2219 1.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6609 1.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0076 -0.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1048 -0.4851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2328 0.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2328 -0.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7889 -0.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3438 -0.4873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7889 -1.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2326 1.4401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0078 1.4401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3438 1.4483 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 1 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 9 17 2 0 0 0 0 18 2 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 1 23 1 0 0 0 0 5 24 1 0 0 0 0 13 25 1 0 0 0 0 S SKP 8 ID FL1CHYNI0002 KNApSAcK_ID C00007004 NAME 5'-Prenyllicodione CAS_RN 107390-47-6 FORMULA C20H20O5 EXACTMASS 340.13107375 AVERAGEMASS 340.3698 SMILES c(c1)(C(CC(=O)c(c2)ccc(O)c2)=O)c(cc(O)c1CC=C(C)C)O M END