Mol:FL5FFCNS0036
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 26 29 0 0 0 0 0 0 0 0999 V2000 -1.3823 -0.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3776 0.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6725 -1.0382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0466 -0.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0513 0.1953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6608 0.6118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4803 0.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7681 0.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0874 0.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8065 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8112 -0.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1014 -1.0301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1893 0.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1865 1.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4741 1.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7651 1.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1014 -1.8551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6725 -1.8632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4769 0.5985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7095 -1.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3528 -0.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9869 0.3525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4769 1.0318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9869 1.7078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0874 1.2782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7329 1.6510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 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 2 1 0 0 0 0 7 8 1 0 0 0 0 8 5 1 0 0 0 0 2 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 1 2 0 0 0 0 7 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 8 2 0 0 0 0 12 17 1 0 0 0 0 3 18 2 0 0 0 0 10 19 1 0 0 0 0 4 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 1 0 0 0 0 24 14 1 0 0 0 0 9 25 1 0 0 0 0 25 26 1 0 0 0 0 S SKP 8 ID FL5FFCNS0036 KNApSAcK_ID C00013513 NAME 2-(1,3-Benzodioxol-5-yl)-5,7-dihydroxy-3,8-dimethoxy-4H-1-benzopyran-4-one;3,8-dimethoxy-5,7-dihydroxy-3',4'-methylenedioxyflavone CAS_RN 132537-17-8 FORMULA C18H14O8 EXACTMASS 358.068867424 AVERAGEMASS 358.29896 SMILES c(c1OC)(O)cc(c(C2=O)c(OC(c(c4)cc(c3c4)OCO3)=C2OC)1)O M END
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