Mol:FL2FA9NC0006
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 43 48 0 0 0 0 0 0 0 0999 V2000 0.9751 -1.2202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9893 -0.3953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7301 -1.6457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4039 -1.2448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3947 -0.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7108 0.0048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1091 0.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7301 -2.3874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8236 -0.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5381 0.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5381 0.8591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8236 1.2716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1091 0.8591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2821 0.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4394 -0.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4394 -1.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2821 -1.6204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2821 -2.3230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2821 0.7817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3558 1.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -0.0228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0696 -1.5595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6692 -1.2133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6692 -0.3883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3837 0.0242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0981 -0.3883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0981 -1.2133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3837 -1.6258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3837 -2.3538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3558 1.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0702 2.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7847 1.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7847 1.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0702 0.7374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5121 0.7300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1091 1.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1091 1.8997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8236 2.3122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5381 1.8997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5381 1.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8236 0.6622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8236 0.0044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3163 2.3629 0.0000 O 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 2 1 0 0 0 0 5 7 1 6 0 0 0 3 8 2 0 0 0 0 7 9 2 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 7 1 0 0 0 0 2 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 1 1 0 0 0 0 17 18 1 0 0 0 0 14 19 1 0 0 0 0 19 20 1 0 0 0 0 15 21 1 0 0 0 0 16 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 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 23 1 0 0 0 0 28 29 1 0 0 0 0 20 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 20 1 0 0 0 0 33 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 41 36 1 0 0 0 0 41 42 1 0 0 0 0 30 43 1 0 0 0 0 S SKP 8 ID FL2FA9NC0006 KNApSAcK_ID C00014264 NAME Isouvarinol;(S)-5,7-Dihydroxy-6-(2-hydroxybenzyl)-8-(2x2-hydroxybenzyl)flavanone CAS_RN 152841-80-0 FORMULA C36H30O7 EXACTMASS 574.199153314 AVERAGEMASS 574.6192 SMILES C(C3)(c(c6)cccc6)Oc(c(Cc(c4)c(ccc(Cc(c5)c(ccc5)O)4)O)1)c(C3=O)c(c(Cc(c2)c(O)ccc2)c(O)1)O M END