Mol:FL4DE8NS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 24 26 0 0 0 0 0 0 0 0999 V2000 -1.7630 -0.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0504 0.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7598 -1.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -1.4135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3304 -0.9978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3341 -0.1728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3859 -1.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0985 -0.9915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0949 -0.1665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3786 0.2428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7486 0.2143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4647 -0.1954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1776 0.2198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1744 1.0448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4583 1.4546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7455 1.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -2.0504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -2.1216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3808 0.1775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6763 -1.3251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4583 2.1216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4647 -0.8656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4397 -1.3967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1776 -0.9707 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 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 4 18 1 0 0 0 0 1 19 1 0 0 0 0 8 20 1 1 0 0 0 15 21 1 0 0 0 0 12 22 1 0 0 0 0 3 23 1 0 0 0 0 23 24 1 0 0 0 0 S SKP 8 ID FL4DE8NS0001 KNApSAcK_ID C00014370 NAME Diosalol;(2R,3R)-3,5,7,2',5'-Pentahydroxy-6-methoxyflavanone CAS_RN 253786-85-5 FORMULA C16H14O8 EXACTMASS 334.068867424 AVERAGEMASS 334.27756 SMILES COc(c(O)3)c(O)c(C(=O)2)c(c3)OC(C(O)2)c(c1)c(O)ccc(O)1 M END