Mol:FL3FEAGS0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 34 0 0 0 0 0 0 0 0999 V2000 -1.1262 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1262 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -2.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2761 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2761 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -0.4789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9773 -2.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6785 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6785 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9773 -0.4789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9773 -2.7295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3795 -0.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 -0.8916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8086 -0.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8086 0.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 0.7588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3795 0.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8271 -0.4790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5231 0.7586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -2.7298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8259 -2.0974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6582 -0.0463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6817 -0.6101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9915 0.4742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6817 1.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6582 2.1289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3484 1.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2607 2.7298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 2.3689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1224 1.6703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5231 -0.0418 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 1 18 1 0 0 0 0 15 19 1 0 0 0 0 20 3 1 0 0 0 0 2 21 1 0 0 0 0 23 22 1 1 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 1 0 0 0 27 22 1 1 0 0 0 26 28 1 0 0 0 0 25 29 1 0 0 0 0 27 30 1 0 0 0 0 22 31 1 0 0 0 0 23 18 1 0 0 0 0 S SKP 5 ID FL3FEAGS0004 FORMULA C21H20O10 EXACTMASS 432.10564686 AVERAGEMASS 432.37749999999994 SMILES C(=O)(C=3)c(c2O)c(OC3c(c4)ccc(O)c4)cc(c2O)OC(O1)C(O)C(O)C(O)C(C)1 M END