Mol:FL5FFANS0023
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 24 26 0 0 0 0 0 0 0 0999 V2000 -1.4288 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4288 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1433 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8578 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8578 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1433 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7144 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0001 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7144 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1433 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1433 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7144 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7144 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5723 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7146 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4291 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1433 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8578 1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5723 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1433 1.4436 0.0000 O 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 1 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 2 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 4 18 1 0 0 0 0 8 19 1 0 0 0 0 19 20 1 0 0 0 0 6 21 1 0 0 0 0 14 22 1 0 0 0 0 22 23 1 0 0 0 0 3 24 1 0 0 0 0 S SKP 8 ID FL5FFANS0023 KNApSAcK_ID C00013355 NAME 5,7,8-Trihydroxy-3,4'-dimethoxyflavone;5,7,8-Trihydroxy-3-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one CAS_RN 97389-86-1 FORMULA C17H14O7 EXACTMASS 330.073952802 AVERAGEMASS 330.28886 SMILES COc(c3)ccc(c3)C(O1)=C(OC)C(=O)c(c(O)2)c1c(O)c(O)c2 M END