-ISIS- 08251614012D 31 34 0 0 0 0 0 0 0 0999 V2000 0.7708 -0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9417 -0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9417 -1.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7708 -1.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1125 -0.4375 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1125 -2.3958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7792 -0.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -0.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6375 -1.9167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5000 -2.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7792 -2.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6375 -0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6125 -3.4167 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1125 0.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5083 -0.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7792 0.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4292 -2.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5958 -3.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 0.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0917 -2.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7792 1.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9917 1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -2.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1292 2.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 -0.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0042 2.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 2.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1292 3.6250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2292 -0.9042 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2167 -1.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0875 -0.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 5 1 0 0 0 0 3 2 2 0 0 0 0 4 1 2 0 0 0 0 5 1 1 0 0 0 0 6 4 1 0 0 0 0 7 2 1 0 0 0 0 8 1 1 0 0 0 0 9 12 1 0 0 0 0 10 9 1 0 0 0 0 11 3 1 0 0 0 0 12 7 1 0 0 0 0 13 10 1 0 0 0 0 14 5 1 0 0 0 0 15 8 1 0 0 0 0 16 7 2 0 0 0 0 17 10 2 0 0 0 0 18 13 1 0 0 0 0 19 8 2 0 0 0 0 20 17 1 0 0 0 0 21 14 2 0 0 0 0 22 14 1 0 0 0 0 23 4 1 0 0 0 0 24 26 1 0 0 0 0 25 15 1 0 0 0 0 26 22 2 0 0 0 0 27 21 1 0 0 0 0 28 24 1 0 0 0 0 29 25 1 0 0 0 0 30 29 1 0 0 0 0 31 29 1 0 0 0 0 6 3 1 0 0 0 0 27 24 2 0 0 0 0 9 11 1 0 0 0 0 20 18 2 0 0 0 0 M END > (STK008739) STK008739 > (STK008739) 6 > (STK008739) 3.66 > (STK008739) 103.87 > (STK008739) 2 > (STK008739) 4 > (STK008739) 4 > (STK008739) 2-methylpropyl 4-(4-hydroxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate > (STK008739) 437.56 > (STK008739) C25H27NO4S > (STK008739) CC(COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)O)C(=O)CC(C2)c1cccs1)C $$$$