Mol:FL2FCBNS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 22 24 0 0 0 0 0 0 0 0999 V2000 -2.4308 0.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4308 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8745 -0.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3182 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3182 0.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8745 0.4661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7619 -0.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2056 -0.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2056 0.1449 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7619 0.4661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3505 0.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9175 0.1386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4845 0.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4845 1.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9175 1.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3505 1.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7619 -1.3624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8745 -1.4608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 0.7637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2879 1.6298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0735 1.4608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 1.0483 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 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 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 7 17 2 0 0 0 0 3 18 1 0 0 0 0 1 19 1 0 0 0 0 19 20 1 0 0 0 0 14 21 1 0 0 0 0 21 22 1 0 0 0 0 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 2 21 22 M SBL 2 1 23 M SMT 2 OCH3 M SVB 2 23 2.0735 1.4608 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 19 20 M SBL 1 1 21 M SMT 1 OCH3 M SVB 1 21 -2.788 0.7637 S SKP 8 ID FL2FCBNS0001 KNApSAcK_ID C00008226 NAME Naringenin 7,4'-dimethyl ether CAS_RN 29424-96-2 FORMULA C17H16O5 EXACTMASS 300.099773622 AVERAGEMASS 300.30593999999996 SMILES COc(c3)ccc(c3)C(C1)Oc(c2)c(c(O)cc(OC)2)C(=O)1 M END