Mol:FL2FACGS0008
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 42 46 0 0 0 0 0 0 0 0999 V2000 -0.6029 -0.3860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6029 -1.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1119 -1.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8266 -1.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8266 -0.3860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1119 0.0266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5414 -1.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2562 -1.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2562 -0.3860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5414 0.0266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9707 0.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6992 -0.3941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4277 0.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4277 0.8676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6992 1.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9707 0.8676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5414 -2.3227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1559 1.2881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3174 0.0264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6992 2.2113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1119 -2.4491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7309 -0.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2579 -0.6454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5767 -0.3805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9195 -0.3734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3971 0.1043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -0.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1778 0.2191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2558 -0.2246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9712 -0.6776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0614 -0.8101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6979 1.3306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5255 0.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2024 1.2696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6179 1.5955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7902 2.2384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1133 1.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9438 0.3101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2589 2.4491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 1.9826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1947 2.3676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1559 1.7637 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 1 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 14 18 1 0 0 0 0 1 19 1 0 0 0 0 20 15 1 0 0 0 0 3 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 22 29 1 0 0 0 0 23 30 1 0 0 0 0 24 31 1 0 0 0 0 33 32 1 1 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 1 0 0 0 37 32 1 1 0 0 0 33 38 1 0 0 0 0 38 28 1 0 0 0 0 36 39 1 0 0 0 0 35 40 1 0 0 0 0 37 41 1 0 0 0 0 32 42 1 0 0 0 0 25 19 1 0 0 0 0 S SKP 5 ID FL2FACGS0008 FORMULA C27H32O15 EXACTMASS 596.174120354 AVERAGEMASS 596.5339799999999 SMILES O(C1C)C(OCC(O2)C(O)C(C(O)C(Oc(c3)cc(O)c(C(=O)5)c3OC(C5)c(c4)cc(c(O)c4)O)2)O)C(C(O)C(O)1)O M END