Mol:FL5FADGSN001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 34 37 0 0 0 0 0 0 0 0999 V2000 2.6696 -0.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9551 0.2070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9551 1.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6696 1.4445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3841 1.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3841 0.2070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2408 -0.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5263 0.2070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1882 -0.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1882 -1.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5263 -1.4429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2408 -1.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9026 0.2070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6171 -0.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6171 -1.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9026 -1.4429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5263 -2.2679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3315 0.2070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9551 -1.4429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9026 -2.2679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0986 1.4445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1622 1.8748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7495 1.1601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9512 1.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1577 1.1424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5703 1.8571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3687 1.6481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8034 2.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4868 2.2679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8222 1.6980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4365 1.3442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7976 0.7961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0872 -0.1989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8222 0.2254 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 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 18 1 0 0 0 0 6 33 1 0 0 0 0 33 34 1 0 0 0 0 S SKP 5 ID FL5FADGSN001 FORMULA C22H23NO11 EXACTMASS 477.127110583 AVERAGEMASS 477.41816 SMILES O(c(c1)c(O)ccc1C(=C4O)Oc(c2)c(C4=O)c(cc2OC(C3N)OC(CO)C(O)C3O)O)C M END