Mol:FL4DBANP0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 32 35 0 0 0 0 0 0 0 0999 V2000 -1.7910 -0.1683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0709 0.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7998 -0.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -1.4120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3714 -1.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3601 -0.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3417 -1.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0598 -1.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0666 -0.2001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3599 0.2184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7884 0.1994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7973 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5164 1.4305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2247 1.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2184 0.1885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4985 -0.2195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3268 -2.2564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7666 -1.4502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -2.1460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0709 1.0556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8017 1.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8017 2.1964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2284 2.5274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3516 2.5139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4993 0.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2165 -0.1683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2165 -0.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4993 -1.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7206 0.3358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8943 -0.3499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8943 1.3981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7475 -2.5274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 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 2 1 0 0 0 0 5 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 6 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 8 18 1 0 0 0 0 4 19 1 0 0 0 0 2 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 1 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 3 1 0 0 0 0 26 29 1 0 0 0 0 26 30 1 0 0 0 0 14 31 1 0 0 0 0 19 32 1 0 0 0 0 S SKP 8 ID FL4DBANP0001 KNApSAcK_ID C00014395 NAME 3,4'-Dihydroxy-5-methoxy-8-prenyl-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone CAS_RN 234429-78-8 FORMULA C26H28O6 EXACTMASS 436.188588628 AVERAGEMASS 436.49692 SMILES Oc(c1)ccc(C(C(O)4)Oc(c3C(=O)4)c(c(c(c3OC)2)OC(C=C2)(C)C)CC=C(C)C)c1 M END