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30 32 1 0 0 0 0 32 33 1 0 0 0 0 29 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 35 1 0 0 0 0 39 41 1 0 0 0 0 41 42 1 0 0 0 0 38 43 1 0 0 0 0 37 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 45 1 0 0 0 0 48 51 1 0 0 0 0 47 52 1 0 0 0 0 46 53 1 0 0 0 0 36 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 55 1 0 0 0 0 59 61 1 0 0 0 0 61 62 1 0 0 0 0 58 63 1 0 0 0 0 57 64 1 0 0 0 0 56 65 1 0 0 0 0 28 66 1 0 0 0 0 27 67 1 0 0 0 0 20 68 1 0 0 0 0 12 69 1 0 0 0 0 6 70 1 0 0 0 0 5 71 1 0 0 0 0 71 72 1 0 0 0 0 72 2 1 0 0 0 0 M END > Tomatine > 17406-45-0 > C50H83NO21 > MFCD00016888 > 1,034.19 > 806.69��C (rough estimate) > 300-305��C > > C[C@H]1CC[C@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O[C@H]9[C@@H]([C@H]([C@@H](CO9)O)O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)C)C)C)NC1 $$$$