Mol:FL5FFCGA0003
From Metabolomics.JP
(Difference between revisions)
Line 1: | Line 1: | ||
− | + | ||
− | + | ||
− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 46 50 0 0 0 0 0 0 0 0999 V2000 | + | 46 50 0 0 0 0 0 0 0 0999 V2000 |
− | -2.2468 -0.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2468 -0.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.2468 -0.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2468 -0.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5323 -1.3974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5323 -1.3974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8179 -0.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8179 -0.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8179 -0.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8179 -0.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5323 0.2526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5323 0.2526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.1034 -1.3974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1034 -1.3974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6110 -0.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6110 -0.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6110 -0.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6110 -0.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.1034 0.2526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1034 0.2526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.1034 -2.0406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1034 -2.0406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.5106 0.4114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5106 0.4114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.2388 -0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2388 -0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.9670 0.4114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9670 0.4114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.9670 1.2522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9670 1.2522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.2388 1.6726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2388 1.6726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.5106 1.2522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5106 1.2522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5323 -2.2221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5323 -2.2221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7463 1.7021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7463 1.7021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.1813 -1.5551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1813 -1.5551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.2388 2.5132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2388 2.5132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5321 1.0221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5321 1.0221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.9749 2.8671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9749 2.8671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.1506 2.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1506 2.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.5047 1.7431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5047 1.7431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.0735 1.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0735 1.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.0141 1.9185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0141 1.9185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6429 2.1749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6429 2.1749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.4747 3.1660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4747 3.1660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.6228 2.6361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6228 2.6361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4438 1.0079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4438 1.0079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.2600 -1.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2600 -1.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.6681 -2.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6681 -2.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.4387 -2.0610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4387 -2.0610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.0685 -2.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0685 -2.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.6605 -2.0195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6605 -2.0195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8897 -1.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8897 -1.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.7069 -1.3433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7069 -1.3433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.2653 -1.6959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2653 -1.6959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.6532 -1.3562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6532 -1.3562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.8507 -2.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8507 -2.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.4883 -3.6103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4883 -3.6103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6089 2.7848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6089 2.7848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.6251 3.6103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6251 3.6103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.9425 0.2652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9425 0.2652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.8507 -0.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8507 -0.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
− | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
− | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
− | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
− | 6 1 2 0 0 0 0 | + | 6 1 2 0 0 0 0 |
− | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
− | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
− | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
− | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
− | 10 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
− | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
− | 9 12 1 0 0 0 0 | + | 9 12 1 0 0 0 0 |
− | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
− | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
− | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
− | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
− | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
− | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
− | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
− | 19 15 1 0 0 0 0 | + | 19 15 1 0 0 0 0 |
− | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
− | 20 8 1 0 0 0 0 | + | 20 8 1 0 0 0 0 |
− | 16 21 1 0 0 0 0 | + | 16 21 1 0 0 0 0 |
− | 6 22 1 0 0 0 0 | + | 6 22 1 0 0 0 0 |
− | 23 24 1 1 0 0 0 | + | 23 24 1 1 0 0 0 |
− | 24 25 1 1 0 0 0 | + | 24 25 1 1 0 0 0 |
− | 26 25 1 1 0 0 0 | + | 26 25 1 1 0 0 0 |
− | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
− | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
− | 28 23 1 0 0 0 0 | + | 28 23 1 0 0 0 0 |
− | 23 29 1 0 0 0 0 | + | 23 29 1 0 0 0 0 |
− | 24 30 1 0 0 0 0 | + | 24 30 1 0 0 0 0 |
− | 25 31 1 0 0 0 0 | + | 25 31 1 0 0 0 0 |
− | 22 26 1 0 0 0 0 | + | 22 26 1 0 0 0 0 |
− | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
− | 33 34 1 1 0 0 0 | + | 33 34 1 1 0 0 0 |
− | 34 35 1 1 0 0 0 | + | 34 35 1 1 0 0 0 |
− | 36 35 1 1 0 0 0 | + | 36 35 1 1 0 0 0 |
− | 36 37 1 0 0 0 0 | + | 36 37 1 0 0 0 0 |
− | 37 32 1 0 0 0 0 | + | 37 32 1 0 0 0 0 |
− | 32 38 1 0 0 0 0 | + | 32 38 1 0 0 0 0 |
− | 37 39 1 0 0 0 0 | + | 37 39 1 0 0 0 0 |
− | 36 40 1 0 0 0 0 | + | 36 40 1 0 0 0 0 |
− | 33 20 1 0 0 0 0 | + | 33 20 1 0 0 0 0 |
− | 41 42 1 0 0 0 0 | + | 41 42 1 0 0 0 0 |
− | 35 41 1 0 0 0 0 | + | 35 41 1 0 0 0 0 |
− | 43 44 1 0 0 0 0 | + | 43 44 1 0 0 0 0 |
− | 28 43 1 0 0 0 0 | + | 28 43 1 0 0 0 0 |
− | 45 46 1 0 0 0 0 | + | 45 46 1 0 0 0 0 |
− | 1 45 1 0 0 0 0 | + | 1 45 1 0 0 0 0 |
− | M STY 1 1 SUP | + | M STY 1 1 SUP |
− | M SLB 1 1 1 | + | M SLB 1 1 1 |
− | M SAL 1 2 41 42 | + | M SAL 1 2 41 42 |
− | M SBL 1 1 46 | + | M SBL 1 1 46 |
− | M SMT 1 CH2OH | + | M SMT 1 CH2OH |
− | M SBV 1 46 -0.7821 0.0986 | + | M SBV 1 46 -0.7821 0.0986 |
− | M STY 1 2 SUP | + | M STY 1 2 SUP |
− | M SLB 1 2 2 | + | M SLB 1 2 2 |
− | M SAL 2 2 43 44 | + | M SAL 2 2 43 44 |
− | M SBL 2 1 48 | + | M SBL 2 1 48 |
− | M SMT 2 CH2OH | + | M SMT 2 CH2OH |
− | M SBV 2 48 -0.0340 -0.6099 | + | M SBV 2 48 -0.0340 -0.6099 |
− | M STY 1 3 SUP | + | M STY 1 3 SUP |
− | M SLB 1 3 3 | + | M SLB 1 3 3 |
− | M SAL 3 2 45 46 | + | M SAL 3 2 45 46 |
− | M SBL 3 1 50 | + | M SBL 3 1 50 |
− | M SMT 3 ^ OCH3 | + | M SMT 3 ^ OCH3 |
− | M SBV 3 50 0.6957 -0.4250 | + | M SBV 3 50 0.6957 -0.4250 |
− | S SKP 5 | + | S SKP 5 |
− | ID FL5FFCGA0003 | + | ID FL5FFCGA0003 |
− | FORMULA C28H32O18 | + | FORMULA C28H32O18 |
− | EXACTMASS 656.1588642199999 | + | EXACTMASS 656.1588642199999 |
− | AVERAGEMASS 656.54288 | + | AVERAGEMASS 656.54288 |
− | SMILES O(c(c52)c(cc(O)c(C(=O)C(=C(O5)c(c4)ccc(O)c4O)OC(C(O)3)OC(C(O)C(O)3)CO)2)OC)C(O1)C(O)C(O)C(O)C1CO | + | SMILES O(c(c52)c(cc(O)c(C(=O)C(=C(O5)c(c4)ccc(O)c4O)OC(C(O)3)OC(C(O)C(O)3)CO)2)OC)C(O1)C(O)C(O)C(O)C1CO |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 46 50 0 0 0 0 0 0 0 0999 V2000 -2.2468 -0.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2468 -0.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5323 -1.3974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8179 -0.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8179 -0.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5323 0.2526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1034 -1.3974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1034 0.2526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1034 -2.0406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5106 0.4114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2388 -0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 0.4114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 1.2522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2388 1.6726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5106 1.2522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5323 -2.2221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7463 1.7021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1813 -1.5551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2388 2.5132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5321 1.0221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9749 2.8671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1506 2.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5047 1.7431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0735 1.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0141 1.9185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6429 2.1749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4747 3.1660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6228 2.6361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4438 1.0079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -1.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6681 -2.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4387 -2.0610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0685 -2.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6605 -2.0195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8897 -1.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7069 -1.3433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2653 -1.6959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6532 -1.3562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8507 -2.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4883 -3.6103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6089 2.7848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6251 3.6103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9425 0.2652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8507 -0.6430 0.0000 C 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 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 3 18 1 0 0 0 0 19 15 1 0 0 0 0 4 3 1 0 0 0 0 20 8 1 0 0 0 0 16 21 1 0 0 0 0 6 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 23 29 1 0 0 0 0 24 30 1 0 0 0 0 25 31 1 0 0 0 0 22 26 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 1 0 0 0 34 35 1 1 0 0 0 36 35 1 1 0 0 0 36 37 1 0 0 0 0 37 32 1 0 0 0 0 32 38 1 0 0 0 0 37 39 1 0 0 0 0 36 40 1 0 0 0 0 33 20 1 0 0 0 0 41 42 1 0 0 0 0 35 41 1 0 0 0 0 43 44 1 0 0 0 0 28 43 1 0 0 0 0 45 46 1 0 0 0 0 1 45 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 41 42 M SBL 1 1 46 M SMT 1 CH2OH M SBV 1 46 -0.7821 0.0986 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 2 43 44 M SBL 2 1 48 M SMT 2 CH2OH M SBV 2 48 -0.0340 -0.6099 M STY 1 3 SUP M SLB 1 3 3 M SAL 3 2 45 46 M SBL 3 1 50 M SMT 3 ^ OCH3 M SBV 3 50 0.6957 -0.4250 S SKP 5 ID FL5FFCGA0003 FORMULA C28H32O18 EXACTMASS 656.1588642199999 AVERAGEMASS 656.54288 SMILES O(c(c52)c(cc(O)c(C(=O)C(=C(O5)c(c4)ccc(O)c4O)OC(C(O)3)OC(C(O)C(O)3)CO)2)OC)C(O1)C(O)C(O)C(O)C1CO M END