Mol:FL3FA8GS0006
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 32 35 0 0 0 0 0 0 0 0999 V2000 -2.1408 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1408 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4264 -0.2213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7119 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7119 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4264 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0026 -0.2213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0026 1.4287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4315 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8605 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8605 2.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 2.6662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4315 2.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0026 -1.0463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8605 1.3632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 0.2561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4264 -1.0792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8217 2.6058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2955 -2.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1145 -1.9310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2324 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7501 -0.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9311 -0.5735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8131 -1.3903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2124 -1.3070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7705 -1.6413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5527 -2.6662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7013 -2.2436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7552 -1.5212 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 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 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 1 1 0 0 0 0 12 19 1 0 0 0 0 3 20 1 0 0 0 0 16 21 1 0 0 0 0 22 23 1 1 0 0 0 23 24 1 1 0 0 0 25 24 1 1 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 22 30 1 0 0 0 0 23 31 1 0 0 0 0 24 32 1 0 0 0 0 25 19 1 0 0 0 0 S SKP 8 ID FL3FA8GS0006 KNApSAcK_ID C00013651 NAME 5,7,2',6'-Tetrahydroxyflavone 2'-O-glucoside;2-[2-(beta-D-Glucopyranosyloxy)-6-hydroxyphenyl]-5,7-dihydroxy-4H-1-benzopyran-4-one CAS_RN 185145-32-8 FORMULA C21H20O11 EXACTMASS 448.100561482 AVERAGEMASS 448.3769 SMILES c(c1OC(O4)C(O)C(O)C(O)C4CO)ccc(O)c1C(=C2)Oc(c3)c(c(cc(O)3)O)C(=O)2 M END