44201168 -OEChem-04252411472D 109112 0 1 0 0 0 0 0999 V2000 4.4641 5.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -6.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -4.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.5670 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9641 6.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.0670 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4641 4.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 6.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5670 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0000 4.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0670 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9282 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.4330 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.9282 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 3.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -4.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -4.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -5.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -5.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4390 6.8315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4892 6.8315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 5.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 6.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 6.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 5.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 5.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.6870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 2.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 5.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 4.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 3.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.4470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 3.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 0.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 1.6496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 0.9593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.4470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1403 0.9844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 1.6746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 -0.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 -1.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 -2.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 2.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 3.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 3.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3722 3.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 3.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7522 2.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 -3.5156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 -2.8253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2708 -3.5407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8723 -2.8504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5822 -4.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1836 -5.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1369 -5.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7383 -4.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1836 -5.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5822 -6.5156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7383 -6.5156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1369 -5.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -4.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -3.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -4.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 16 2 0 0 0 0 3 20 2 0 0 0 0 4 27 2 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 31 2 0 0 0 0 7 41 2 0 0 0 0 15 8 1 1 0 0 0 8 20 1 0 0 0 0 8 62 1 0 0 0 0 21 9 1 1 0 0 0 9 27 1 0 0 0 0 9 73 1 0 0 0 0 25 10 1 6 0 0 0 10 31 1 0 0 0 0 10 77 1 0 0 0 0 30 11 1 1 0 0 0 11 41 1 0 0 0 0 11 87 1 0 0 0 0 12 36 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 6 0 0 0 14 53 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 55 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 18 59 1 0 0 0 0 18 60 1 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 19 61 1 0 0 0 0 20 21 1 0 0 0 0 21 24 1 0 0 0 0 21 63 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 67 1 0 0 0 0 23 68 1 0 0 0 0 23 69 1 0 0 0 0 24 29 1 0 0 0 0 24 71 1 0 0 0 0 24 72 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 70 1 0 0 0 0 26 28 1 0 0 0 0 26 74 1 0 0 0 0 26 75 1 0 0 0 0 28 33 1 0 0 0 0 28 34 1 0 0 0 0 28 76 1 0 0 0 0 29 37 2 0 0 0 0 29 38 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 78 1 0 0 0 0 32 35 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 33 81 1 0 0 0 0 33 82 1 0 0 0 0 33 83 1 0 0 0 0 34 84 1 0 0 0 0 34 85 1 0 0 0 0 34 86 1 0 0 0 0 35 44 1 0 0 0 0 35 88 1 0 0 0 0 35 89 1 0 0 0 0 36 41 1 0 0 0 0 36 90 1 0 0 0 0 36 91 1 0 0 0 0 37 45 1 0 0 0 0 37 92 1 0 0 0 0 38 46 2 0 0 0 0 38 93 1 0 0 0 0 39 42 1 0 0 0 0 39 94 1 0 0 0 0 39 95 1 0 0 0 0 40 43 1 0 0 0 0 40 96 1 0 0 0 0 40 97 1 0 0 0 0 42 98 1 0 0 0 0 42 99 1 0 0 0 0 43100 1 0 0 0 0 43101 1 0 0 0 0 44 48 2 0 0 0 0 44 49 1 0 0 0 0 45 47 2 0 0 0 0 45102 1 0 0 0 0 46 47 1 0 0 0 0 46103 1 0 0 0 0 47104 1 0 0 0 0 48 50 1 0 0 0 0 48105 1 0 0 0 0 49 51 2 0 0 0 0 49106 1 0 0 0 0 50 52 2 0 0 0 0 50107 1 0 0 0 0 51 52 1 0 0 0 0 51108 1 0 0 0 0 52109 1 0 0 0 0 M END > 44201168 > 1 > 1180 > 8 > 4 > 20 > AAADcfB/uAAAAAAAAAAAAAAAEgAAAAAAAAA8YIAAAAAAAAABQAAAHgAQAAAADWzhmAYyAIPABACIAqFSEAICAAAgAAAIiIHIAIgKYDaAkTWXIAAmtgCYiAe4yPCOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (2S)-N-[(1S)-1-benzyl-2-[[(1S)-3-methyl-1-[(2S)-2-methyloxirane-2-carbonyl]butyl]amino]-2-oxo-ethyl]-4-methyl-2-[[(2S)-2-[(2-morpholinoacetyl)amino]-4-phenyl-butanoyl]amino]pentanamide > (2S)-4-methyl-N-[(2S)-1-[[(2S)-4-methyl-1-[(2S)-2-methyl-2-oxiranyl]-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-2-[[(2S)-2-[[2-(4-morpholinyl)-1-oxoethyl]amino]-1-oxo-4-phenylbutyl]amino]pentanamide > (2S)-4-methyl-N-[(2S)-1-[[(2S)-4-methyl-1-[(2S)-2-methyloxiran-2-yl]-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-2-[[(2S)-2-[(2-morpholin-4-ylacetyl)amino]-4-phenylbutanoyl]amino]pentanamide > (2S)-4-methyl-N-[(2S)-1-[[(2S)-4-methyl-1-[(2S)-2-methyloxiran-2-yl]-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-2-[[(2S)-2-[(2-morpholin-4-ylacetyl)amino]-4-phenylbutanoyl]amino]pentanamide > (2S)-4-methyl-N-[(2S)-1-[[(2S)-4-methyl-1-[(2S)-2-methyloxiran-2-yl]-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-2-[[(2S)-2-(2-morpholin-4-ylethanoylamino)-4-phenyl-butanoyl]amino]pentanamide > (2S)-N-[(1S)-1-benzyl-2-keto-2-[[(1S)-3-methyl-1-[(2S)-2-methyloxirane-2-carbonyl]butyl]amino]ethyl]-4-methyl-2-[[(2S)-2-[(2-morpholinoacetyl)amino]-4-phenyl-butanoyl]amino]valeramide > InChI=1S/C40H57N5O7/c1-27(2)22-32(36(47)40(5)26-52-40)42-39(50)34(24-30-14-10-7-11-15-30)44-38(49)33(23-28(3)4)43-37(48)31(17-16-29-12-8-6-9-13-29)41-35(46)25-45-18-20-51-21-19-45/h6-15,27-28,31-34H,16-26H2,1-5H3,(H,41,46)(H,42,50)(H,43,48)(H,44,49)/t31-,32-,33-,34-,40-/m0/s1 > BLMPQMFVWMYDKT-IKKRJENISA-N > 4.7 > 719.42579917 > C40H57N5O7 > 719.9 > CC(C)CC(C(=O)C1(CO1)C)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CC(C)C)NC(=O)C(CCC3=CC=CC=C3)NC(=O)CN4CCOCC4 > CC(C)C[C@@H](C(=O)[C@@]1(CO1)C)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC3=CC=CC=C3)NC(=O)CN4CCOCC4 > 159 > 719.42579917 > 0 > 52 > 5 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 25 10 6 30 11 5 13 17 6 29 37 8 29 38 8 37 45 8 38 46 8 44 48 8 44 49 8 45 47 8 46 47 8 48 50 8 49 51 8 50 52 8 51 52 8 15 8 5 21 9 5 $$$$