Mol:FL5FACGS0118
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 66 72 0 0 0 0 0 0 0 0999 V2000 3.5353 2.1024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8208 2.5149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8208 3.3399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5353 3.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2498 3.3399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2498 2.5149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1065 2.1024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 2.5149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6775 2.1024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6775 1.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 0.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1065 1.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 2.5149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7514 2.1024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7514 1.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 0.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 0.2041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4659 2.5149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7053 0.8319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 0.1382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8416 3.6816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5353 4.4782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1877 2.9412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7751 2.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9768 2.4356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1833 2.2087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5959 2.9235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3943 2.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7302 3.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3726 3.2032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8416 2.7659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4996 2.4206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3242 1.7831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -1.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8686 -1.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0472 -0.9876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6114 -0.3857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1799 0.3175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0012 -0.4879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2616 -0.7156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2811 -1.9505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2358 -0.5191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8198 -3.2752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6376 -3.1648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7471 -2.3468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2582 -1.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4403 -1.8092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3307 -2.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5498 -2.8606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8198 -4.0183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -3.7183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5982 -2.1187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -3.7637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -3.0502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -2.3367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0559 -3.0502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4678 -3.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2917 -3.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7042 -3.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5292 -3.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9417 -3.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5292 -4.4782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7042 -4.4782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7656 -3.7637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1073 -2.4711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8335 -2.4711 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 23 24 1 1 0 0 0 24 25 1 1 0 0 0 26 25 1 1 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 23 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 23 31 1 0 0 0 0 24 32 1 0 0 0 0 25 33 1 0 0 0 0 26 18 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 1 0 0 0 37 36 1 1 0 0 0 38 37 1 1 0 0 0 38 39 1 0 0 0 0 39 34 1 0 0 0 0 37 40 1 0 0 0 0 35 41 1 0 0 0 0 36 42 1 0 0 0 0 19 38 1 0 0 0 0 43 44 1 1 0 0 0 44 45 1 1 0 0 0 46 45 1 1 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 43 1 0 0 0 0 48 49 1 0 0 0 0 43 50 1 0 0 0 0 44 51 1 0 0 0 0 45 52 1 0 0 0 0 46 40 1 0 0 0 0 53 54 1 0 0 0 0 54 55 2 0 0 0 0 54 56 1 0 0 0 0 56 57 2 0 0 0 0 57 58 1 0 0 0 0 58 59 2 0 0 0 0 59 60 1 0 0 0 0 60 61 2 0 0 0 0 61 62 1 0 0 0 0 62 63 2 0 0 0 0 63 58 1 0 0 0 0 61 64 1 0 0 0 0 60 65 1 0 0 0 0 65 66 1 0 0 0 0 53 49 1 0 0 0 0 S SKP 5 ID FL5FACGS0118 FORMULA C42H46O24 EXACTMASS 934.2379024 AVERAGEMASS 934.8002399999999 SMILES c(c1)(O)c(O)ccc1C(O2)=C(OC(C(OC(C(O)7)OC(C(O)C7O)COC(=O)C=Cc(c6)cc(OC)c(c6)O)5)OCC(O)C(O)5)C(=O)c(c4O)c2cc(c4)OC(C(O)3)OC(CO)C(O)C3O M END