Mol:FL2FABNP0001
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 26 29 0 0 0 0 0 0 0 0999 V2000 -2.4708 0.1065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4523 -0.6973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6751 -1.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0203 -0.6814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0061 0.1435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7318 0.5685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2653 -1.1069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4085 -0.7060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3992 0.1604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2846 0.5436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1137 0.5729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8048 0.1864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5162 0.5849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5366 1.4097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8249 1.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1045 1.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2653 -1.8486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2611 1.8044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6751 -1.7846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8916 1.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7623 1.4396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5319 1.8486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 1.3866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2405 0.5156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 1.8346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8916 1.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 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 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 18 14 1 0 0 0 0 3 19 1 0 0 0 0 18 20 1 0 0 0 0 6 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 1 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 S SKP 8 ID FL2FABNP0001 KNApSAcK_ID C00014231 NAME 5-Hydroxy-4'-methoxy-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone CAS_RN 509078-09-5 FORMULA C21H20O5 EXACTMASS 352.13107375 AVERAGEMASS 352.3805 SMILES C(=O)(C1)c(c(O)3)c(c(C=4)c(OC(C4)(C)C)c3)OC1c(c2)ccc(OC)c2 M END
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