60156841 -OEChem-04252403022D 80 83 0 1 0 0 0 0 0999 V2000 12.4603 -0.8720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.3512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.6488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0023 -2.7909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8237 3.1433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.1488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.6488 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.3512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.8512 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7942 -1.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5542 -1.3859 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6603 0.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.8512 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.4603 0.1696 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3244 0.6729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5542 0.6834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1882 -2.1592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1884 1.1763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8277 -0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8210 1.5370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0147 1.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3455 2.4852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8455 3.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 -1.8262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 -1.8262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1637 -1.4994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.4712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1972 -0.2540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5470 1.3034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7087 -2.5523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5812 -2.6387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6676 -1.7662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 -1.8262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 -1.8262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4048 1.5411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0063 2.2314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5005 0.6405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7242 1.4883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8764 1.7120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2920 -0.5032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1398 -0.7269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3634 0.1209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3568 1.8491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5090 2.0728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2853 1.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1742 -3.3512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4142 -3.3512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8858 1.1356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -0.3763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -0.3763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7289 2.4204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5934 3.9176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -1.8262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -1.8262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.2688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.1612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.4588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 1.6488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.2688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 1.6488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 15 1 0 0 0 0 2 19 1 0 0 0 0 2 28 1 0 0 0 0 3 18 2 0 0 0 0 4 19 2 0 0 0 0 5 27 1 0 0 0 0 5 32 1 0 0 0 0 6 26 2 0 0 0 0 7 35 1 0 0 0 0 7 40 1 0 0 0 0 8 13 1 0 0 0 0 8 18 1 0 0 0 0 8 22 1 0 0 0 0 9 26 1 0 0 0 0 9 30 1 0 0 0 0 9 63 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 19 1 6 0 0 0 11 14 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 20 1 6 0 0 0 12 43 1 0 0 0 0 13 17 2 0 0 0 0 14 18 1 0 0 0 0 14 21 1 6 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 45 1 1 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 17 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 26 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 27 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 27 29 2 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 29 31 1 0 0 0 0 29 67 1 0 0 0 0 30 33 1 0 0 0 0 30 68 1 0 0 0 0 30 69 1 0 0 0 0 31 32 2 0 0 0 0 31 70 1 0 0 0 0 32 71 1 0 0 0 0 33 34 1 0 0 0 0 33 72 1 0 0 0 0 33 73 1 0 0 0 0 34 35 1 0 0 0 0 34 36 2 0 0 0 0 35 37 2 0 0 0 0 36 38 1 0 0 0 0 36 74 1 0 0 0 0 37 39 1 0 0 0 0 37 75 1 0 0 0 0 38 39 2 0 0 0 0 38 76 1 0 0 0 0 39 77 1 0 0 0 0 40 78 1 0 0 0 0 40 79 1 0 0 0 0 40 80 1 0 0 0 0 M END > 60156841 > 1 > 960 > 7 > 1 > 11 > AAADcfB7OAAAAAAAAAAAAAAAAAAAASAAAAA8QIAAAAAAAACBwAAAHgAQAAAADxzhmAYyDoPABECIAq3S2ACCCAAkIgAIiIGODMgOJj6EtTuHOSjn9hGYqYe936LPAAAAAAAIAAAAAAAAABAAAAAAAAAAAA== > methyl (3R,4aR,5R,7R)-7-tert-butyl-1-(2-furylmethyl)-3-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxo-ethyl]-5-methyl-2-oxo-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > (3R,4aR,5R,7R)-7-tert-butyl-1-(2-furanylmethyl)-3-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl]-5-methyl-2-oxo-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylic acid methyl ester > methyl (3R,4aR,5R,7R)-7-tert-butyl-1-(furan-2-ylmethyl)-3-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl]-5-methyl-2-oxo-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > methyl (3R,4aR,5R,7R)-7-tert-butyl-1-(furan-2-ylmethyl)-3-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl]-5-methyl-2-oxo-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > methyl (3R,4aR,5R,7R)-7-tert-butyl-1-(furan-2-ylmethyl)-3-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-5-methyl-2-oxidanylidene-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylate > (3R,4aR,5R,7R)-7-tert-butyl-1-(2-furfuryl)-2-keto-3-[2-keto-2-[2-(2-methoxyphenyl)ethylamino]ethyl]-5-methyl-3,4,5,7-tetrahydropyrano[4,3-b]pyridine-4a-carboxylic acid methyl ester > InChI=1S/C31H40N2O7/c1-20-31(29(36)38-6)18-22(16-27(34)32-14-13-21-10-7-8-12-24(21)37-5)28(35)33(19-23-11-9-15-39-23)25(31)17-26(40-20)30(2,3)4/h7-12,15,17,20,22,26H,13-14,16,18-19H2,1-6H3,(H,32,34)/t20-,22+,26-,31+/m1/s1 > HXZCHWCSSUHBRA-RSKXWFEESA-N > 3.3 > 552.28355162 > C31H40N2O7 > 552.7 > CC1C2(CC(C(=O)N(C2=CC(O1)C(C)(C)C)CC3=CC=CO3)CC(=O)NCCC4=CC=CC=C4OC)C(=O)OC > C[C@@H]1[C@]2(C[C@@H](C(=O)N(C2=C[C@@H](O1)C(C)(C)C)CC3=CC=CO3)CC(=O)NCCC4=CC=CC=C4OC)C(=O)OC > 107 > 552.28355162 > 0 > 40 > 4 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 19 6 12 20 6 14 21 6 15 45 5 27 29 8 29 31 8 31 32 8 34 35 8 34 36 8 35 37 8 36 38 8 37 39 8 38 39 8 5 27 8 5 32 8 $$$$