44201868 -OEChem-05092415262D 85 88 0 1 0 0 0 0 0999 V2000 2.0000 -4.1280 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.2426 0.1147 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9904 0.2315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4674 -1.1101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2939 -2.8440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3344 1.0183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4157 -0.3031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5203 -1.6209 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8816 -1.4279 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7944 -1.5583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9157 0.5630 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0532 -2.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5173 -2.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8479 -1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3816 -0.5619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9498 0.8218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5244 1.3563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8284 -1.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9192 -3.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5015 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6512 -3.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7852 -2.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5540 -1.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1418 2.2802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1213 -2.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2265 -2.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7804 -0.6553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7505 3.0736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1503 2.4107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3801 -2.9726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1554 -1.7478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1927 -2.0714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0743 0.0527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3678 3.9974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7676 3.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -3.6797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4483 -2.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3764 4.1280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7071 -3.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4528 -1.1059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8989 -2.7795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4191 -0.8484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8652 -2.5220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1253 -1.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3066 -1.8793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3560 -1.9968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5344 0.5224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4332 -2.5243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8927 -3.1232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6659 -3.1262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1368 -2.5487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3562 -0.8154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5866 -0.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2118 1.3837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4419 1.1774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9433 0.8992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0473 1.6894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0904 -0.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3206 -0.9439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0382 -0.7949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5207 -3.4992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3177 -3.4992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6512 -3.6443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7852 -1.9043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7181 -2.6839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4877 -2.8912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3420 -0.9181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1367 -0.1479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3652 2.9926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7729 1.9188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 -3.1330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9949 -1.1490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5127 0.3155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7180 -0.4547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7453 4.4893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1529 3.4155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8335 -4.2786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8494 -2.2945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 4.7008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0150 -0.6669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7376 -3.3782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5804 -0.2497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3030 -2.9610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9335 1.1780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7244 -1.3968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 39 1 0 0 0 0 2 16 1 0 0 0 0 2 20 1 0 0 0 0 3 15 2 0 0 0 0 4 20 2 0 0 0 0 5 23 2 0 0 0 0 6 33 1 0 0 0 0 6 84 1 0 0 0 0 7 11 1 0 0 0 0 7 15 1 0 0 0 0 7 60 1 0 0 0 0 8 23 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 13 1 0 0 0 0 9 14 1 6 0 0 0 9 15 1 0 0 0 0 9 45 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 1 0 0 0 10 20 1 0 0 0 0 10 46 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 6 0 0 0 11 47 1 0 0 0 0 12 19 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 21 1 0 0 0 0 13 50 1 0 0 0 0 13 51 1 0 0 0 0 14 23 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 24 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 18 25 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 22 1 0 0 0 0 19 61 1 0 0 0 0 19 62 1 0 0 0 0 21 22 2 0 0 0 0 21 63 1 0 0 0 0 22 64 1 0 0 0 0 24 28 2 0 0 0 0 24 29 1 0 0 0 0 25 30 2 0 0 0 0 25 31 1 0 0 0 0 26 32 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 27 33 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 28 34 1 0 0 0 0 28 69 1 0 0 0 0 29 35 2 0 0 0 0 29 70 1 0 0 0 0 30 36 1 0 0 0 0 30 71 1 0 0 0 0 31 37 2 0 0 0 0 31 72 1 0 0 0 0 32 40 2 0 0 0 0 32 41 1 0 0 0 0 33 73 1 0 0 0 0 33 74 1 0 0 0 0 34 38 2 0 0 0 0 34 75 1 0 0 0 0 35 38 1 0 0 0 0 35 76 1 0 0 0 0 36 39 2 0 0 0 0 36 77 1 0 0 0 0 37 39 1 0 0 0 0 37 78 1 0 0 0 0 38 79 1 0 0 0 0 40 42 1 0 0 0 0 40 80 1 0 0 0 0 41 43 2 0 0 0 0 41 81 1 0 0 0 0 42 44 2 0 0 0 0 42 82 1 0 0 0 0 43 44 1 0 0 0 0 43 83 1 0 0 0 0 44 85 1 0 0 0 0 M END > 44201868 > 1 > 908 > 6 > 2 > 10 > AAADcfB/OQAAAAAAAAAAAAAAAAAAAAAAAAAwYMAAAAAAAAABUAAAHwAQCAAADSjhmA4wCIPABgCIAiHSGACCAAAgAAAIiIEIBIgKMDKAkRGHIAhklgCYiAedyOCOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > N-benzyl-2-[(3S,6S,8E,12S)-3-benzyl-12-[(4-fluorophenyl)methyl]-5,13-dioxo-1-oxa-4-azacyclotridec-8-en-6-yl]-N-(2-hydroxyethyl)acetamide > 2-[(3S,6S,8E,12S)-12-[(4-fluorophenyl)methyl]-5,13-dioxo-3-(phenylmethyl)-1-oxa-4-azacyclotridec-8-en-6-yl]-N-(2-hydroxyethyl)-N-(phenylmethyl)acetamide > N-benzyl-2-[(3S,6S,8E,12S)-3-benzyl-12-[(4-fluorophenyl)methyl]-5,13-dioxo-1-oxa-4-azacyclotridec-8-en-6-yl]-N-(2-hydroxyethyl)acetamide > N-benzyl-2-[(3S,6S,8E,12S)-3-benzyl-12-[(4-fluorophenyl)methyl]-5,13-dioxo-1-oxa-4-azacyclotridec-8-en-6-yl]-N-(2-hydroxyethyl)acetamide > 2-[(3S,6S,8E,12S)-12-[(4-fluorophenyl)methyl]-5,13-bis(oxidanylidene)-3-(phenylmethyl)-1-oxa-4-azacyclotridec-8-en-6-yl]-N-(2-hydroxyethyl)-N-(phenylmethyl)ethanamide > N-benzyl-2-[(3S,6S,8E,12S)-3-benzyl-12-(4-fluorobenzyl)-5,13-diketo-1-oxa-4-azacyclotridec-8-en-6-yl]-N-(2-hydroxyethyl)acetamide > InChI=1S/C36H41FN2O5/c37-32-18-16-28(17-19-32)22-31-15-9-3-8-14-30(24-34(41)39(20-21-40)25-29-12-6-2-7-13-29)35(42)38-33(26-44-36(31)43)23-27-10-4-1-5-11-27/h1-8,10-13,16-19,30-31,33,40H,9,14-15,20-26H2,(H,38,42)/b8-3+/t30-,31-,33-/m0/s1 > MAHGACPOILQTGQ-SUCIBOGCSA-N > 5.2 > 600.29995057 > C36H41FN2O5 > 600.7 > C1CC(C(=O)OCC(NC(=O)C(CC=C1)CC(=O)N(CCO)CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=C(C=C4)F > C\1C[C@H](C(=O)OC[C@@H](NC(=O)[C@@H](C/C=C1)CC(=O)N(CCO)CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=C(C=C4)F > 95.9 > 600.29995057 > 0 > 44 > 3 > 0 > 1 > 0 > 0 > 1 > -1 > 1 5 255 > 10 18 5 11 17 6 24 28 8 24 29 8 25 30 8 25 31 8 28 34 8 29 35 8 30 36 8 31 37 8 32 40 8 32 41 8 34 38 8 35 38 8 36 39 8 37 39 8 40 42 8 41 43 8 42 44 8 43 44 8 9 14 6 $$$$