Mol:FL5FAGGS0035
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 41 44 0 0 0 0 0 0 0 0999 V2000 1.7862 1.3902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 1.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 2.6277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 3.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 2.6277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 1.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 1.3902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 1.8027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 1.3902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 0.5652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 0.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 0.5652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 1.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 1.3902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 0.5652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 0.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -0.5543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2151 1.8027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 0.1527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 -0.5383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 3.0402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 3.8652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1786 1.4113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7873 -2.1426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0367 -2.1868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2972 -1.4037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9203 -0.8626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0961 -0.8183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1643 -1.6014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1146 -1.3216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3387 -2.8066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8297 -2.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3248 -1.8992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9831 -2.3063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8659 -1.9946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1235 -3.3978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5157 -3.8652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3637 -3.4838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -3.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8757 -2.7754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5162 -3.6509 0.0000 C 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 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 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 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 12 19 1 0 0 0 0 16 20 1 0 0 0 0 5 21 1 0 0 0 0 4 22 1 0 0 0 0 6 23 1 0 0 0 0 24 25 1 1 0 0 0 25 26 1 1 0 0 0 27 26 1 1 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 24 1 0 0 0 0 26 30 1 0 0 0 0 25 31 1 0 0 0 0 24 32 1 0 0 0 0 27 19 1 0 0 0 0 30 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 31 36 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 32 39 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 S SKP 5 ID FL5FAGGS0035 FORMULA C26H24O15 EXACTMASS 576.111520098 AVERAGEMASS 576.45976 SMILES CC(=O)OC(C4OC(C)=O)C(OC(C)=O)C(OC4)OC(C(=O)1)=C(c(c3)cc(c(c(O)3)O)O)Oc(c2)c1c(cc2O)O M END