122706909 -OEChem-08192221172D 158166 0 1 0 0 0 0 0999 V2000 4.7586 -0.1222 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6587 -1.1817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.5723 -7.0704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0783 -3.5760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.6596 2.2918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.4097 -4.7434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.7561 -2.1950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8182 -3.1592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.9539 -6.7403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5639 -6.3140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.2546 -0.8018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 32.4596 7.4919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7834 -4.6909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6808 2.6496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6713 -5.6365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 30.3519 2.3551 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5581 -2.5832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.0723 -3.8797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2036 -4.8478 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 31.1728 0.2635 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8336 -5.1359 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.1688 -6.3795 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5198 1.8635 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.4488 -4.6616 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 20.4585 -4.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.3074 2.0604 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 31.8776 2.8747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0686 -5.4894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.2806 3.6696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8166 -6.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2383 -3.3162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 -1.1150 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2132 -3.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.3396 3.3491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8934 -3.8268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1449 -1.7952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0723 -3.8797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7514 -1.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5723 -6.0704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0936 -5.7119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8683 -3.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5652 -2.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.6728 1.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.5256 1.7918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1785 -4.6253 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 23.4732 -5.6365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.5754 4.6252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4733 -3.6698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5485 -4.3373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.4509 0.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6958 -4.6616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.1839 0.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5234 -4.1148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7989 -6.6675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4135 -4.9789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8587 -5.3584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2258 -6.3567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 0.2709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6863 -4.3392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7931 -2.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4482 -3.4472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.8952 5.3582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.5503 4.8477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.4509 0.5030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1438 -6.1570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.9678 -0.9045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8239 -6.8900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4385 -5.2014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5138 -5.8689 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 25.4553 -5.0418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.2235 -6.0573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.9749 -1.2192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.2113 -0.5107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7197 1.2637 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.4887 -5.6464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.1900 6.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.8451 5.8033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.1649 6.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2190 -6.8245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5829 -3.4692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.6285 -3.7676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.8017 -2.4934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8001 1.6567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7276 -7.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.5242 -0.1188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.4346 7.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1137 -3.8804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5771 -3.9665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8658 -4.3931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 32.1515 1.9600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 32.3453 2.4677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 32.3314 3.2971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7600 -6.7615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7175 -3.6526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4791 -3.8875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2959 -0.9015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7340 -2.7573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9724 -2.5224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 29.8332 3.7069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3726 -4.1631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1342 -4.3981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 -1.2991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6127 -2.1132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8033 -3.3211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3891 -3.2679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6275 -3.0329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 32.2910 1.0832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7568 -4.1708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8950 -4.1243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0276 -4.6737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7893 -4.9086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0208 -5.4403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2206 -7.1220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5962 -4.3864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.0808 -6.9595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 0.3049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6981 -0.3329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.8172 -3.7332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2476 -2.5150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3714 -2.4822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3386 -3.3584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5861 -4.0517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0526 -3.3093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3102 -2.8428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 30.2907 5.2203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 32.9720 4.3932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 28.0013 0.9299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 30.4272 -1.3210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6965 -5.2765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6412 -7.4825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0168 -4.7469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0163 -4.5434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6456 1.8793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9861 -6.9719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 30.7683 6.7683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 33.4495 5.9412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6265 -6.6418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0362 -7.4170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8114 -7.0073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.6624 -4.0841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 28.2022 -3.4977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.5490 -3.1527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.0091 -3.7391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.7222 -1.8785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.1823 -2.4649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4458 2.4791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0899 1.6198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.1237 -7.5741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.5873 -8.3183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.3315 -7.8547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.9476 0.3341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.0713 0.3047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.1007 -0.5716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 33.5725 7.1100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 34.0390 7.8524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 33.2966 8.3189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1106 2.8933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 33 1 1 1 0 0 0 1 59 1 0 0 0 0 2 39 2 0 0 0 0 3 40 2 0 0 0 0 4 43 2 0 0 0 0 5 45 2 0 0 0 0 6 71 1 0 0 0 0 6 82 1 0 0 0 0 7 73 1 0 0 0 0 7 83 1 0 0 0 0 8 54 2 0 0 0 0 9 72 1 0 0 0 0 9 85 1 0 0 0 0 10 57 2 0 0 0 0 11 74 1 0 0 0 0 11 86 1 0 0 0 0 12 79 1 0 0 0 0 12 87 1 0 0 0 0 13 76 2 0 0 0 0 14 84 1 0 0 0 0 14158 1 0 0 0 0 15 84 2 0 0 0 0 16 25 1 0 0 0 0 16 31 1 0 0 0 0 16 40 1 0 0 0 0 17 27 1 0 0 0 0 17 35 1 0 0 0 0 17 45 1 0 0 0 0 18 32 1 0 0 0 0 18 39 1 0 0 0 0 18 43 1 0 0 0 0 19 38 2 0 0 0 0 19 52 1 0 0 0 0 46 20 1 1 0 0 0 20 54 1 0 0 0 0 20113 1 0 0 0 0 21 44 2 0 0 0 0 21 53 1 0 0 0 0 22 57 1 0 0 0 0 70 22 1 6 0 0 0 22133 1 0 0 0 0 23 66 1 0 0 0 0 23 76 1 0 0 0 0 23135 1 0 0 0 0 75 24 1 1 0 0 0 24147 1 0 0 0 0 24148 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 88 1 6 0 0 0 26 29 1 0 0 0 0 26 89 1 0 0 0 0 26 90 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 91 1 6 0 0 0 28 30 1 0 0 0 0 28 92 1 0 0 0 0 28 93 1 0 0 0 0 29 31 2 0 0 0 0 29 41 1 0 0 0 0 30 35 2 0 0 0 0 30 48 1 0 0 0 0 31 94 1 0 0 0 0 32 34 1 0 0 0 0 32 95 1 0 0 0 0 32 96 1 0 0 0 0 33 37 1 0 0 0 0 33 39 1 0 0 0 0 33 97 1 0 0 0 0 34 36 1 0 0 0 0 34 98 1 0 0 0 0 34 99 1 0 0 0 0 35100 1 0 0 0 0 36 42 1 0 0 0 0 36101 1 0 0 0 0 36102 1 0 0 0 0 37 43 1 0 0 0 0 37103 1 0 0 0 0 37104 1 0 0 0 0 38105 1 0 0 0 0 40 47 1 0 0 0 0 41 55 2 0 0 0 0 41 56 1 0 0 0 0 42 50 1 0 0 0 0 42106 1 0 0 0 0 42107 1 0 0 0 0 44108 1 0 0 0 0 45 51 1 0 0 0 0 46 49 1 0 0 0 0 46 57 1 0 0 0 0 46109 1 0 0 0 0 47 52 1 0 0 0 0 47 58 2 0 0 0 0 48 63 2 0 0 0 0 48 64 1 0 0 0 0 49 61 1 0 0 0 0 49 62 1 0 0 0 0 49110 1 0 0 0 0 50 54 1 0 0 0 0 50111 1 0 0 0 0 50112 1 0 0 0 0 51 53 1 0 0 0 0 51 65 2 0 0 0 0 52 60 2 0 0 0 0 53 67 2 0 0 0 0 55 68 1 0 0 0 0 55114 1 0 0 0 0 56 69 2 0 0 0 0 56115 1 0 0 0 0 58 72 1 0 0 0 0 58116 1 0 0 0 0 59 75 1 0 0 0 0 59117 1 0 0 0 0 59118 1 0 0 0 0 60 71 1 0 0 0 0 60119 1 0 0 0 0 61120 1 0 0 0 0 61121 1 0 0 0 0 61122 1 0 0 0 0 62123 1 0 0 0 0 62124 1 0 0 0 0 62125 1 0 0 0 0 63 77 1 0 0 0 0 63126 1 0 0 0 0 64 78 2 0 0 0 0 64127 1 0 0 0 0 65 74 1 0 0 0 0 65128 1 0 0 0 0 66 68 2 0 0 0 0 66 69 1 0 0 0 0 67 73 1 0 0 0 0 67129 1 0 0 0 0 68131 1 0 0 0 0 69132 1 0 0 0 0 70 76 1 0 0 0 0 70 80 1 0 0 0 0 70130 1 0 0 0 0 71 72 2 0 0 0 0 73 74 2 0 0 0 0 75 84 1 0 0 0 0 75134 1 0 0 0 0 77 79 2 0 0 0 0 77136 1 0 0 0 0 78 79 1 0 0 0 0 78137 1 0 0 0 0 80138 1 0 0 0 0 80139 1 0 0 0 0 80140 1 0 0 0 0 81 82 1 0 0 0 0 81 83 1 0 0 0 0 81141 1 0 0 0 0 81142 1 0 0 0 0 82143 1 0 0 0 0 82144 1 0 0 0 0 83145 1 0 0 0 0 83146 1 0 0 0 0 85149 1 0 0 0 0 85150 1 0 0 0 0 85151 1 0 0 0 0 86152 1 0 0 0 0 86153 1 0 0 0 0 86154 1 0 0 0 0 87155 1 0 0 0 0 87156 1 0 0 0 0 87157 1 0 0 0 0 M END > 122706909 > 1 > 2600 > 18 > 5 > 27 > AAADcfB//ABAAAAAAAAAAAAAAAAAAWIEAAAwYMGABAgAAACBVAAAHgQQCAAADSzl2AayzoPABgioAjX3XACCCAAlIhAIiIG+7MgPZjrk9buWearn1jnq6ce/3LPOKEABAgACQABQgAIEAASAAAAAAAAAAA== > (2R)-3-[(3R)-1-[6-[[(1S)-1-[[(1S)-2-[4-[(6aS)-3-[3-[[(6aS)-2-methoxy-8-(4-methoxyphenyl)-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]anilino]-1-methyl-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]amino]-6-oxo-hexyl]-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-2-amino-propanoic acid > (2R)-3-[[(3R)-1-[6-[[(2S)-1-[[(2S)-1-[4-[(6aS)-3-[3-[[(6aS)-2-methoxy-8-(4-methoxyphenyl)-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]anilino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-6-oxohexyl]-2,5-dioxo-3-pyrrolidinyl]thio]-2-aminopropanoic acid > (2R)-3-[(3R)-1-[6-[[(2S)-1-[[(2S)-1-[4-[(6aS)-3-[3-[[(6aS)-2-methoxy-8-(4-methoxyphenyl)-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]anilino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-2-aminopropanoic acid > (2R)-3-[(3R)-1-[6-[[(2S)-1-[[(2S)-1-[4-[(6aS)-3-[3-[[(6aS)-2-methoxy-8-(4-methoxyphenyl)-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]anilino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-6-oxohexyl]-2,5-dioxopyrrolidin-3-yl]sulfanyl-2-aminopropanoic acid > (2R)-3-[(3R)-1-[6-[[(2S)-1-[[(2S)-1-[[4-[(6aS)-3-[3-[[(6aS)-2-methoxy-8-(4-methoxyphenyl)-11-oxidanylidene-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-11-oxidanylidene-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]phenyl]amino]-1-oxidanylidene-propan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-6-oxidanylidene-hexyl]-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-2-azanyl-propanoic acid > (2R)-3-[[(3R)-1-[6-[[(1S)-1-[[(1S)-2-[4-[(6aS)-3-[3-[[(6aS)-11-keto-2-methoxy-8-(4-methoxyphenyl)-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-11-keto-2-methoxy-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]anilino]-2-keto-1-methyl-ethyl]carbamoyl]-2-methyl-propyl]amino]-6-keto-hexyl]-2,5-diketo-pyrrolidin-3-yl]thio]-2-amino-propionic acid > InChI=1S/C63H71N9O14S/c1-35(2)57(69-55(73)11-8-7-9-20-70-56(74)29-54(62(70)79)87-34-47(64)63(80)81)59(76)67-36(3)58(75)68-41-16-12-37(13-17-41)39-23-42-30-65-48-27-52(50(83-5)25-45(48)60(77)71(42)32-39)85-21-10-22-86-53-28-49-46(26-51(53)84-6)61(78)72-33-40(24-43(72)31-66-49)38-14-18-44(82-4)19-15-38/h12-19,25-28,30-33,35-36,42-43,47,54,57H,7-11,20-24,29,34,64H2,1-6H3,(H,67,76)(H,68,75)(H,69,73)(H,80,81)/t36-,42-,43-,47-,54+,57-/m0/s1 > BNJNAEJASPUJTO-DUOHOMBCSA-N > 1.3 > 1209.48411915 > C63H71N9O14S > 1210.4 > CC(C)C(C(=O)NC(C)C(=O)NC1=CC=C(C=C1)C2=CN3C(C2)C=NC4=CC(=C(C=C4C3=O)OC)OCCCOC5=C(C=C6C(=C5)N=CC7CC(=CN7C6=O)C8=CC=C(C=C8)OC)OC)NC(=O)CCCCCN9C(=O)CC(C9=O)SCC(C(=O)O)N > C[C@@H](C(=O)NC1=CC=C(C=C1)C2=CN3[C@@H](C2)C=NC4=CC(=C(C=C4C3=O)OC)OCCCOC5=C(C=C6C(=C5)N=C[C@@H]7CC(=CN7C6=O)C8=CC=C(C=C8)OC)OC)NC(=O)[C@H](C(C)C)NC(=O)CCCCCN9C(=O)C[C@H](C9=O)SC[C@@H](C(=O)O)N > 325 > 1209.48411915 > 0 > 87 > 6 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 33 1 5 46 20 5 70 22 6 75 24 5 25 88 6 27 91 6 41 55 8 41 56 8 47 52 8 47 58 8 48 63 8 48 64 8 51 53 8 51 65 8 52 60 8 53 67 8 55 68 8 56 69 8 58 72 8 60 71 8 63 77 8 64 78 8 65 74 8 66 68 8 66 69 8 67 73 8 71 72 8 73 74 8 77 79 8 78 79 8 $$$$