60157301 -OEChem-03282409382D 82 86 0 1 0 0 0 0 0999 V2000 13.3263 -0.6220 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.8988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8683 -2.5409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8807 1.9920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.3988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.1012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.1012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.6012 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.1904 0.9229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3263 0.4196 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.4202 -1.1359 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6603 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.6012 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.1055 0.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2911 1.9178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4202 0.9334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7717 1.2654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2684 2.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0542 -1.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6897 3.3933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7116 3.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2116 2.7352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2252 0.3039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3214 1.2696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0297 -1.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 -1.5762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 -1.5762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2573 -0.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7976 -0.0184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6085 0.1572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2239 2.5342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6711 1.9155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4131 1.5534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1884 0.8063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2719 1.6318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8338 2.3839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0746 2.7184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5747 -2.3023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4472 -2.3887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5337 -1.5162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 -1.5762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 -1.5762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2708 1.7911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8723 2.4814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -0.1263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -0.1263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -2.6838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -1.9936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0403 -3.1012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -3.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2803 -3.1012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -0.5186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -1.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -3.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -3.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1504 3.8082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4594 4.1676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5950 2.6704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -3.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -3.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.5643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.6382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 25 1 0 0 0 0 2 33 1 0 0 0 0 3 24 2 0 0 0 0 4 25 2 0 0 0 0 5 30 1 0 0 0 0 5 38 1 0 0 0 0 6 29 2 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 39 2 0 0 0 0 9 17 1 0 0 0 0 9 24 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 39 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 12 25 1 6 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 13 20 1 0 0 0 0 13 42 1 0 0 0 0 14 21 1 0 0 0 0 14 43 1 1 0 0 0 15 26 1 6 0 0 0 15 44 1 0 0 0 0 16 18 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 21 2 0 0 0 0 18 24 1 0 0 0 0 18 27 1 6 0 0 0 18 47 1 0 0 0 0 19 22 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 23 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 29 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 30 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 30 36 2 0 0 0 0 31 34 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 35 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 33 70 1 0 0 0 0 34 71 1 0 0 0 0 34 72 1 0 0 0 0 35 73 1 0 0 0 0 35 74 1 0 0 0 0 36 37 1 0 0 0 0 36 75 1 0 0 0 0 37 38 2 0 0 0 0 37 76 1 0 0 0 0 38 77 1 0 0 0 0 40 41 1 0 0 0 0 40 78 1 0 0 0 0 40 79 1 0 0 0 0 41 80 1 0 0 0 0 41 81 1 0 0 0 0 41 82 1 0 0 0 0 M END > 60157301 > 1 > 1030 > 8 > 0 > 9 > AAADcfB7PAAAAAAAAAAAAAAAAAAAAaIAAAAsWIAAAAAAAACBgAAAHgAAAAAADxzhkAYyDIMABECIAK3S2ACCCAAkIgAIiAGODMgOZj6EtTufGSjn5hGYqYed3wLPAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > methyl (3R,4aR,5R,7S)-7-cyclopentyl-3-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxo-ethyl]-1-(2-furylmethyl)-5-methyl-2-oxo-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > (3R,4aR,5R,7S)-7-cyclopentyl-3-[2-(4-ethoxycarbonyl-1-piperazinyl)-2-oxoethyl]-1-(2-furanylmethyl)-5-methyl-2-oxo-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylic acid methyl ester > methyl (3R,4aR,5R,7S)-7-cyclopentyl-3-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxoethyl]-1-(furan-2-ylmethyl)-5-methyl-2-oxo-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > methyl (3R,4aR,5R,7S)-7-cyclopentyl-3-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxoethyl]-1-(furan-2-ylmethyl)-5-methyl-2-oxo-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > methyl (3R,4aR,5R,7S)-7-cyclopentyl-3-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-1-(furan-2-ylmethyl)-5-methyl-2-oxidanylidene-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > (3R,4aR,5R,7S)-3-[2-(4-carbethoxypiperazino)-2-keto-ethyl]-7-cyclopentyl-1-(2-furfuryl)-2-keto-5-methyl-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylic acid methyl ester > InChI=1S/C30H41N3O8/c1-4-39-29(37)32-13-11-31(12-14-32)26(34)16-22-18-30(28(36)38-3)20(2)41-24(21-8-5-6-9-21)17-25(30)33(27(22)35)19-23-10-7-15-40-23/h7,10,15,17,20-22,24H,4-6,8-9,11-14,16,18-19H2,1-3H3/t20-,22+,24-,30+/m1/s1 > LJPUFYNUJNNQIJ-JMBULEGUSA-N > 1.7 > 571.28936527 > C30H41N3O8 > 571.7 > CCOC(=O)N1CCN(CC1)C(=O)CC2CC3(C(OC(C=C3N(C2=O)CC4=CC=CO4)C5CCCC5)C)C(=O)OC > CCOC(=O)N1CCN(CC1)C(=O)C[C@H]2C[C@@]3([C@H](O[C@H](C=C3N(C2=O)CC4=CC=CO4)C5CCCC5)C)C(=O)OC > 119 > 571.28936527 > 0 > 41 > 4 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 25 6 14 43 5 15 26 6 18 27 6 30 36 8 36 37 8 37 38 8 5 30 8 5 38 8 $$$$