56589223 -OEChem-04262402242D 80 83 0 1 0 0 0 0 0999 V2000 2.6691 -1.8433 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.4449 -1.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9869 -3.6897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -1.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7788 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5388 -2.2847 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6448 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4449 -0.7292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.5388 -0.2153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3090 -0.2258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1728 -3.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1730 0.2775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8123 -1.0899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8056 0.6382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -3.2445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -3.4524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3803 -2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1774 -2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1483 -2.3982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1818 -1.1528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5316 0.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6933 -3.4511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5658 -3.5375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6522 -2.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6482 -2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4453 -2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3894 0.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9909 1.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4851 -0.2583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7088 0.5896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8610 0.8132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2766 -1.4020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1244 -1.6257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3480 -0.7779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3414 0.9503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4936 1.1740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2699 0.3262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3022 1.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7008 0.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9909 2.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3894 2.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3894 3.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9909 4.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3113 4.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5143 4.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8347 4.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4362 3.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1588 -4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -4.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3988 -4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8472 -1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0502 -1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9389 -3.6594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 -4.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -2.5216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 1 38 1 0 0 0 0 2 11 1 0 0 0 0 2 14 1 0 0 0 0 3 18 1 0 0 0 0 3 31 1 0 0 0 0 4 17 2 0 0 0 0 5 18 2 0 0 0 0 6 26 2 0 0 0 0 7 12 1 0 0 0 0 7 17 1 0 0 0 0 7 21 1 0 0 0 0 8 26 1 0 0 0 0 8 34 1 0 0 0 0 8 68 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 18 1 6 0 0 0 10 13 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 19 1 6 0 0 0 11 41 1 0 0 0 0 12 15 2 0 0 0 0 13 17 1 0 0 0 0 13 20 1 6 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 43 1 1 0 0 0 15 44 1 0 0 0 0 16 22 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 26 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 25 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 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 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 27 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 27 28 1 0 0 0 0 27 30 2 0 0 0 0 28 29 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 29 32 1 0 0 0 0 29 65 1 0 0 0 0 29 66 1 0 0 0 0 30 33 1 0 0 0 0 30 67 1 0 0 0 0 31 73 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 32 33 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 33 71 1 0 0 0 0 33 72 1 0 0 0 0 34 35 1 0 0 0 0 34 76 1 0 0 0 0 34 77 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 36 78 1 0 0 0 0 37 38 2 0 0 0 0 37 79 1 0 0 0 0 38 80 1 0 0 0 0 M END > 56589223 > 1 > 970 > 6 > 1 > 10 > AAADcfB7OABAAAAAAAAAAAAAAAAAASAAAAAsQIAAAAAAAACBgAAAHgQQAAAADxzl0AayCYPABAiMAiXSWACDAIAgChBIiJkIBIgIJD6gsRGGEAhn9gCoqAed34LPAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > methyl (3R,4aR,5R,7R)-7-tert-butyl-1-[2-(cyclohexen-1-yl)ethyl]-5-methyl-2-oxo-3-[2-oxo-2-(2-thienylmethylamino)ethyl]-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > (3R,4aR,5R,7R)-7-tert-butyl-1-[2-(1-cyclohexenyl)ethyl]-5-methyl-2-oxo-3-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylic acid methyl ester > methyl (3R,4aR,5R,7R)-7-tert-butyl-1-[2-(cyclohexen-1-yl)ethyl]-5-methyl-2-oxo-3-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > methyl (3R,4aR,5R,7R)-7-tert-butyl-1-[2-(cyclohexen-1-yl)ethyl]-5-methyl-2-oxo-3-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > methyl (3R,4aR,5R,7R)-7-tert-butyl-1-[2-(cyclohexen-1-yl)ethyl]-5-methyl-2-oxidanylidene-3-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > (3R,4aR,5R,7R)-7-tert-butyl-1-[2-(cyclohexen-1-yl)ethyl]-2-keto-3-[2-keto-2-(2-thenylamino)ethyl]-5-methyl-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylic acid methyl ester > InChI=1S/C30H42N2O5S/c1-20-30(28(35)36-5)18-22(16-26(33)31-19-23-12-9-15-38-23)27(34)32(14-13-21-10-7-6-8-11-21)24(30)17-25(37-20)29(2,3)4/h9-10,12,15,17,20,22,25H,6-8,11,13-14,16,18-19H2,1-5H3,(H,31,33)/t20-,22+,25-,30+/m1/s1 > YMORNMVVHYEMKL-GUHRBLPXSA-N > 4 > 542.28144362 > C30H42N2O5S > 542.7 > CC1C2(CC(C(=O)N(C2=CC(O1)C(C)(C)C)CCC3=CCCCC3)CC(=O)NCC4=CC=CS4)C(=O)OC > C[C@@H]1[C@]2(C[C@@H](C(=O)N(C2=C[C@@H](O1)C(C)(C)C)CCC3=CCCCC3)CC(=O)NCC4=CC=CS4)C(=O)OC > 113 > 542.28144362 > 0 > 38 > 4 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 35 8 1 38 8 11 19 6 13 20 6 14 43 5 35 36 8 36 37 8 37 38 8 9 18 6 $$$$