70290600 -OEChem-05102404432D 68 71 0 1 0 0 0 0 0999 V2000 10.7282 -2.7327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3525 0.7218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -2.7327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6988 -0.2381 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1714 -1.0008 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -1.2327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.3415 0.5127 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.2327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -3.2327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1769 -0.8963 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5942 -1.2327 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5078 -1.6394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6769 -0.0302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7592 -0.1918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7537 -0.2963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 3.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -2.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.1980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -3.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5146 -0.3763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0743 -0.8950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1978 -2.1763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0094 -2.0038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2433 0.2219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4853 0.5594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2380 0.1767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4236 -1.5672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4728 -0.3403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0742 0.3499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5976 -2.2076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3947 -2.2076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3856 0.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7841 -0.3153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5287 -0.7577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7316 -0.7577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5828 -0.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3110 -0.5681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3991 1.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5932 1.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9581 0.4479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0894 1.0791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.6127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3991 3.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5932 3.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 3.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.6127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -3.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.5780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -3.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.3998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -3.0656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 17 2 0 0 0 0 3 22 2 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 4 43 1 0 0 0 0 5 10 1 0 0 0 0 5 17 1 0 0 0 0 5 44 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 20 1 0 0 0 0 7 57 1 0 0 0 0 7 58 1 0 0 0 0 8 22 1 0 0 0 0 8 27 1 0 0 0 0 8 59 1 0 0 0 0 9 30 2 0 0 0 0 9 32 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 15 18 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 19 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 22 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 23 25 1 0 0 0 0 23 55 1 0 0 0 0 24 26 2 0 0 0 0 24 56 1 0 0 0 0 25 28 2 0 0 0 0 25 60 1 0 0 0 0 26 28 1 0 0 0 0 26 61 1 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 28 62 1 0 0 0 0 29 31 1 0 0 0 0 29 63 1 0 0 0 0 30 64 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 32 34 2 0 0 0 0 33 35 1 0 0 0 0 33 65 1 0 0 0 0 34 36 1 0 0 0 0 34 66 1 0 0 0 0 35 36 2 0 0 0 0 35 67 1 0 0 0 0 36 68 1 0 0 0 0 M END > 70290600 > 1 > 743 > 6 > 4 > 10 > AAADcfB7sAAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAACx9AAAHgAQAAAADCjBngQ8wPPIEACoAzV3VACCgCAxEiAI2KG4dJgIYPrA0bGUIAhglgDIyAccgYAOAAAAAAACAAAAAAAAAAQAAAAAAAAAAA== > 4-[(2-aminoacetyl)amino]-N-[3-oxo-3-(3-quinolylamino)propyl]-N-(2-phenylethyl)pyrrolidine-2-carboxamide > 4-[(2-amino-1-oxoethyl)amino]-N-[3-oxo-3-(3-quinolinylamino)propyl]-N-(2-phenylethyl)-2-pyrrolidinecarboxamide > 4-[(2-aminoacetyl)amino]-N-[3-oxo-3-(quinolin-3-ylamino)propyl]-N-(2-phenylethyl)pyrrolidine-2-carboxamide > 4-[(2-aminoacetyl)amino]-N-[3-oxo-3-(quinolin-3-ylamino)propyl]-N-(2-phenylethyl)pyrrolidine-2-carboxamide > 4-(2-azanylethanoylamino)-N-[3-oxidanylidene-3-(quinolin-3-ylamino)propyl]-N-(2-phenylethyl)pyrrolidine-2-carboxamide > 4-(glycylamino)-N-[3-keto-3-(3-quinolylamino)propyl]-N-phenethyl-pyrrolidine-2-carboxamide > InChI=1S/C27H32N6O3/c28-16-26(35)32-22-15-24(30-18-22)27(36)33(12-10-19-6-2-1-3-7-19)13-11-25(34)31-21-14-20-8-4-5-9-23(20)29-17-21/h1-9,14,17,22,24,30H,10-13,15-16,18,28H2,(H,31,34)(H,32,35) > XGXWSCFOAJTTQB-UHFFFAOYSA-N > 1 > 488.25358890 > C27H32N6O3 > 488.6 > C1C(CNC1C(=O)N(CCC2=CC=CC=C2)CCC(=O)NC3=CC4=CC=CC=C4N=C3)NC(=O)CN > C1C(CNC1C(=O)N(CCC2=CC=CC=C2)CCC(=O)NC3=CC4=CC=CC=C4N=C3)NC(=O)CN > 129 > 488.25358890 > 0 > 36 > 0 > 2 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 14 3 21 23 8 21 24 8 23 25 8 24 26 8 25 28 8 26 28 8 27 29 8 27 30 8 29 31 8 31 32 8 31 33 8 32 34 8 33 35 8 34 36 8 35 36 8 10 5 3 9 30 8 9 32 8 $$$$