Mol:FL3FALNP0017
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 32 35 0 0 0 0 0 0 0 0999 V2000 -0.3082 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3082 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0227 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0227 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4062 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1207 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1207 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4062 1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8352 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5496 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2641 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2641 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5496 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8352 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4062 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7372 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7372 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0227 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9786 2.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5496 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8352 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8352 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5496 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5496 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3621 -1.7933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8318 -0.8748 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4516 1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1661 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1661 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4516 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9786 0.6817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4483 1.6002 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 17 2 0 0 0 0 16 4 2 0 0 0 0 4 1 1 0 0 0 0 1 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 2 1 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 9 1 0 0 0 0 5 15 2 0 0 0 0 17 16 1 0 0 0 0 4 18 1 0 0 0 0 12 19 1 0 0 0 0 10 20 1 0 0 0 0 6 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 17 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 16 1 0 0 0 0 28 31 1 0 0 0 0 28 32 1 0 0 0 0 S SKP 8 ID FL3FALNP0017 KNApSAcK_ID C00013459 NAME Morusignin L;8-(2,4-Dihydroxyphenyl)-5-hydroxy-7-(3-hydroxy-3-methylbutyl)-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-6-one CAS_RN 149733-95-9 FORMULA C25H26O7 EXACTMASS 438.167853186 AVERAGEMASS 438.46974 SMILES c(c43)(OC(C=C4)(C)C)cc(O1)c(c3O)C(=O)C(=C1c(c2O)ccc(O)c2)CCC(C)(C)O M END