Mol:FL2FABNI0009
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 32 34 0 0 0 0 0 0 0 0999 V2000 -3.5586 -1.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5401 -2.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7629 -2.4178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1081 -2.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0939 -1.1919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8196 -0.7668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3531 -2.4422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6793 -2.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6885 -1.1749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3724 -0.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0259 -0.7624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -1.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4284 -0.7504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4488 0.0743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7371 0.5041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0167 0.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3531 -3.1840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2731 -0.8163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7629 -3.2679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0719 0.4341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7042 0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1297 -1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8442 -0.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5586 -1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5586 -1.9803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2731 -0.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7371 1.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4516 1.6677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4516 2.4927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6391 2.3494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1694 3.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 2.9052 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 5 1 0 0 0 0 9 11 1 6 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 1 18 1 0 0 0 0 3 19 1 0 0 0 0 14 20 1 0 0 0 0 20 21 1 0 0 0 0 13 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 15 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 S SKP 8 ID FL2FABNI0009 KNApSAcK_ID C00014200 NAME Burttinone;5,7-Dihydroxy-4'-methoxy-3'-prenyl-5'-[(3-methyl-2-butenyl)phenyl]flavanone CAS_RN 213819-43-3 FORMULA C26H30O6 EXACTMASS 438.204238692 AVERAGEMASS 438.51279999999997 SMILES c(c1)(C(C3)Oc(c(C3=O)2)cc(O)cc2O)cc(CC=C(C)C)c(OC)c1C=CC(C)(C)O M END