70689318 -OEChem-04162402582D 150156 0 1 0 0 0 0 0999 V2000 7.7331 0.6631 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.1631 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.3369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.3369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.3369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -2.3369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.6631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 1.1631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.1631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.1631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3933 -2.3369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.3369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.8369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.3369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.3369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.3369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6092 -0.4567 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.1631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4736 -6.6881 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.1631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7099 4.4950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.6631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 4.1631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.3369 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1350 -1.8369 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0752 -3.2766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.3369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.8369 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4324 -4.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1575 -0.8521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.3369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2178 -0.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7744 -4.9824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.3369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.8369 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0010 0.6631 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9446 0.4457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -1.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -0.3369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1316 -5.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3942 -1.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9452 0.4789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.6631 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2690 3.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.1631 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4731 1.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -0.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 4.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4742 1.3610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2381 5.1518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0021 2.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0026 2.2100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2166 5.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0428 3.7580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -0.3369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -1.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 2.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 3.6631 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5702 5.8961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5272 6.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 4.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 -0.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -2.3369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 -1.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8809 6.8466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8594 7.0528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 5.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 5.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 5.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 6.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 6.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 7.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3157 -2.5490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.4569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4737 -3.7515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6121 -2.9666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.7169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8390 -1.4813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0338 -3.5677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8954 -4.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7775 -0.8521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2652 -0.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.9569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 -1.5269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1729 -5.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3113 -4.6724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.9569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -3.3369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.9569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 -3.3369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -1.3000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -2.3739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.2169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.3531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 -0.3369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3278 0.1380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5307 0.1380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7331 -5.2735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5947 -6.0584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3736 -1.6864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 1.6380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4685 1.6380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8872 -0.8739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1800 -0.9042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0569 4.2457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6584 3.5554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 1.4731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 2.4731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0928 1.2741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8545 1.3816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0666 0.1881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8637 0.1881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3297 2.7032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0751 -7.1631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0842 -6.7958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7106 2.7569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.4731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1706 3.1513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 0.2831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -2.1469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3263 4.4280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 3.3531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9636 5.7682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1339 6.4364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2753 3.5804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6738 4.2707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0643 -0.5269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -2.9569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4668 7.3081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 3.2831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 7.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 4.7831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 3.8531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 5.3531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4662 5.3531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9303 -2.0269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 6.9731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4662 6.9731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 7.7831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 2 56 1 0 0 0 0 3 30 2 0 0 0 0 4 32 2 0 0 0 0 5 33 2 0 0 0 0 6 41 2 0 0 0 0 7 47 2 0 0 0 0 8 52 2 0 0 0 0 9 60 2 0 0 0 0 10 65 2 0 0 0 0 11 72 1 0 0 0 0 11147 1 0 0 0 0 12 25 1 0 0 0 0 12 30 1 0 0 0 0 12 91 1 0 0 0 0 13 24 1 0 0 0 0 13 32 1 0 0 0 0 13 92 1 0 0 0 0 14 28 1 0 0 0 0 14 41 1 0 0 0 0 14 95 1 0 0 0 0 15 33 1 0 0 0 0 15 39 1 0 0 0 0 15104 1 0 0 0 0 16 38 1 0 0 0 0 16 52 1 0 0 0 0 16112 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17114 1 0 0 0 0 18 47 1 0 0 0 0 48 18 1 6 0 0 0 18118 1 0 0 0 0 19 43 1 0 0 0 0 19124 1 0 0 0 0 19125 1 0 0 0 0 50 20 1 6 0 0 0 20 65 1 0 0 0 0 20127 1 0 0 0 0 21 61 1 0 0 0 0 21 62 1 0 0 0 0 21131 1 0 0 0 0 22 60 1 0 0 0 0 22140 1 0 0 0 0 22141 1 0 0 0 0 66 23 1 6 0 0 0 23143 1 0 0 0 0 23144 1 0 0 0 0 24 26 1 1 0 0 0 24 30 1 0 0 0 0 24 81 1 0 0 0 0 25 27 1 1 0 0 0 25 33 1 0 0 0 0 25 82 1 0 0 0 0 26 29 1 0 0 0 0 26 83 1 0 0 0 0 26 84 1 0 0 0 0 27 36 1 0 0 0 0 27 37 1 0 0 0 0 27 85 1 0 0 0 0 28 31 1 6 0 0 0 28 32 1 0 0 0 0 28 86 1 0 0 0 0 29 35 1 0 0 0 0 29 87 1 0 0 0 0 29 88 1 0 0 0 0 31 34 1 0 0 0 0 31 89 1 0 0 0 0 31 90 1 0 0 0 0 34 40 1 0 0 0 0 34 44 2 0 0 0 0 35 43 1 0 0 0 0 35 93 1 0 0 0 0 35 94 1 0 0 0 0 36 96 1 0 0 0 0 36 97 1 0 0 0 0 36 98 1 0 0 0 0 37 99 1 0 0 0 0 37100 1 0 0 0 0 37101 1 0 0 0 0 38 41 1 0 0 0 0 38 42 1 6 0 0 0 38102 1 0 0 0 0 39 46 1 0 0 0 0 39 47 1 6 0 0 0 39103 1 0 0 0 0 40 45 1 0 0 0 0 40 51 2 0 0 0 0 42 53 1 0 0 0 0 42105 1 0 0 0 0 42106 1 0 0 0 0 43107 1 0 0 0 0 43108 1 0 0 0 0 44109 1 0 0 0 0 45 55 2 0 0 0 0 46110 1 0 0 0 0 46111 1 0 0 0 0 48 49 1 0 0 0 0 48 60 1 0 0 0 0 48113 1 0 0 0 0 49 54 1 0 0 0 0 49115 1 0 0 0 0 49116 1 0 0 0 0 50 52 1 0 0 0 0 50 56 1 0 0 0 0 50117 1 0 0 0 0 51 58 1 0 0 0 0 51119 1 0 0 0 0 53 63 2 0 0 0 0 53 64 1 0 0 0 0 54 57 1 0 0 0 0 54 62 2 0 0 0 0 55 59 1 0 0 0 0 55120 1 0 0 0 0 56121 1 0 0 0 0 56122 1 0 0 0 0 57 61 1 0 0 0 0 57 67 2 0 0 0 0 58 59 2 0 0 0 0 58123 1 0 0 0 0 59126 1 0 0 0 0 61 68 2 0 0 0 0 62128 1 0 0 0 0 63 70 1 0 0 0 0 63129 1 0 0 0 0 64 71 2 0 0 0 0 64130 1 0 0 0 0 65 66 1 0 0 0 0 66 69 1 0 0 0 0 66132 1 0 0 0 0 67 73 1 0 0 0 0 67133 1 0 0 0 0 68 74 1 0 0 0 0 68134 1 0 0 0 0 69 75 1 0 0 0 0 69135 1 0 0 0 0 69136 1 0 0 0 0 70 72 2 0 0 0 0 70137 1 0 0 0 0 71 72 1 0 0 0 0 71138 1 0 0 0 0 73 74 2 0 0 0 0 73139 1 0 0 0 0 74142 1 0 0 0 0 75 76 2 0 0 0 0 75 77 1 0 0 0 0 76 78 1 0 0 0 0 76145 1 0 0 0 0 77 79 2 0 0 0 0 77146 1 0 0 0 0 78 80 2 0 0 0 0 78148 1 0 0 0 0 79 80 1 0 0 0 0 79149 1 0 0 0 0 80150 1 0 0 0 0 M END > 70689318 > 1 > 2080 > 13 > 13 > 18 > AAADcfB//ABgAAAAAAAAAAAAAAAAAWLAAAAwYMGAAAAAAFgB/gAAHgQQCAAADSzF3gS+xvLJkgCoAzV3VACCgCAxIiAI2aG+bJgIZvLCkbOUcAhk1hHI2AeYyeCOoAAAAAACAABAAAAAAAQAAAAAAAAAAA== > (4R,7S,10S,13S,16R,19R)-10-(4-aminobutyl)-N-[(1S)-2-amino-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-19-[[(2R)-2-amino-3-phenyl-propanoyl]amino]-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-7-isopropyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide > (4R,7S,10S,13S,16R,19R)-10-(4-aminobutyl)-N-[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-19-[[(2R)-2-amino-1-oxo-3-phenylpropyl]amino]-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-7-propan-2-yl-1,2-dithia-5,8,11,14,17-pentazacycloeicosane-4-carboxamide > (4R,7S,10S,13S,16R,19R)-10-(4-aminobutyl)-N-[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-19-[[(2R)-2-amino-3-phenylpropanoyl]amino]-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-7-propan-2-yl-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide > (4R,7S,10S,13S,16R,19R)-10-(4-aminobutyl)-N-[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-19-[[(2R)-2-amino-3-phenylpropanoyl]amino]-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-7-propan-2-yl-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide > (4R,7S,10S,13S,16R,19R)-10-(4-azanylbutyl)-N-[(2S)-1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-19-[[(2R)-2-azanyl-3-phenyl-propanoyl]amino]-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentakis(oxidanylidene)-7-propan-2-yl-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide > (4R,7S,10S,13S,16R,19R)-10-(4-aminobutyl)-N-[(1S)-2-amino-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-19-[[(2R)-2-amino-3-phenyl-propanoyl]amino]-16-(4-hydroxybenzyl)-13-(1H-indol-3-ylmethyl)-7-isopropyl-6,9,12,15,18-pentaketo-1,2-dithia-5,8,11,14,17-pentazacycloeicosane-4-carboxamide > InChI=1S/C57H70N12O9S2/c1-32(2)49-57(78)68-48(55(76)64-44(50(60)71)26-35-28-61-41-16-8-6-14-38(35)41)31-80-79-30-47(67-51(72)40(59)24-33-12-4-3-5-13-33)56(77)65-45(25-34-19-21-37(70)22-20-34)53(74)66-46(27-36-29-62-42-17-9-7-15-39(36)42)54(75)63-43(52(73)69-49)18-10-11-23-58/h3-9,12-17,19-22,28-29,32,40,43-49,61-62,70H,10-11,18,23-27,30-31,58-59H2,1-2H3,(H2,60,71)(H,63,75)(H,64,76)(H,65,77)(H,66,74)(H,67,72)(H,68,78)(H,69,73)/t40-,43+,44+,45-,46+,47+,48+,49+/m1/s1 > SWXOGPJRIDTIRL-KTJGOPLGSA-N > 3.6 > 1130.48301420 > C57H70N12O9S2 > 1131.4 > CC(C)C1C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=C(C=C4)O)NC(=O)C(CC5=CC=CC=C5)N)C(=O)NC(CC6=CNC7=CC=CC=C76)C(=O)N > CC(C)[C@H]1C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=C(C=C4)O)NC(=O)[C@@H](CC5=CC=CC=C5)N)C(=O)N[C@@H](CC6=CNC7=CC=CC=C76)C(=O)N > 401 > 1130.48301420 > 0 > 80 > 8 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 17 44 8 17 45 8 48 18 6 50 20 6 21 61 8 21 62 8 66 23 6 24 26 5 25 27 5 28 31 6 34 40 8 34 44 8 38 42 6 39 47 6 40 45 8 40 51 8 45 55 8 51 58 8 53 63 8 53 64 8 54 57 8 54 62 8 55 59 8 57 61 8 57 67 8 58 59 8 61 68 8 63 70 8 64 71 8 67 73 8 68 74 8 70 72 8 71 72 8 73 74 8 75 76 8 75 77 8 76 78 8 77 79 8 78 80 8 79 80 8 $$$$