Mol:FL1DACNP0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 36 38 0 0 0 0 0 0 0 0999 V2000 -2.5059 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5059 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7914 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7914 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3625 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0665 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7809 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4954 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4954 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7809 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0665 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3625 -3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7914 -3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2204 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3625 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7809 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7914 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5059 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5059 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7914 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2204 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2204 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9348 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9348 3.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2204 3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6493 3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2099 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9243 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9243 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2099 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 0.2070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6493 -0.6068 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 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 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 3 17 1 0 0 0 0 1 18 1 0 0 0 0 5 19 1 0 0 0 0 14 20 1 0 0 0 0 6 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 12 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 13 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 S SKP 8 ID FL1DACNP0001 KNApSAcK_ID C00014621 NAME 2',4',6',3-Tetrahydroxy-3'-geranyl-6'',6''-dimethylpyrano[2'',3'':4,5]dihydrochalcone CAS_RN 205109-18-8 FORMULA C30H36O6 EXACTMASS 492.251188884 AVERAGEMASS 492.60324 SMILES Oc(c(CC=C(C)CCC=C(C)C)1)cc(O)c(C(CCc(c2)cc(O)c(O3)c2C=CC(C)(C)3)=O)c(O)1 M END