Mol:FL5FACNS0001
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 22 24 0 0 0 0 0 0 0 0999 V2000 -1.9630 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4067 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8504 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8504 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4067 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2941 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2622 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2622 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2941 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2941 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8183 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3853 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9523 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9523 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3853 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8183 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8183 -1.1394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5191 0.1451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4067 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3853 1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5191 1.1270 0.0000 O 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 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 9 12 1 0 0 0 0 12 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 17 2 0 0 0 0 17 12 1 0 0 0 0 8 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 16 21 1 0 0 0 0 15 22 1 0 0 0 0 S SKP 8 ID FL5FACNS0001 KNApSAcK_ID C00004631 NAME Quercetin CAS_RN 117-39-5 FORMULA C15H10O7 EXACTMASS 302.042652674 AVERAGEMASS 302.2357 SMILES Oc(c3)cc(O1)c(c(O)3)C(=O)C(O)=C1c(c2)cc(O)c(O)c2 M END
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