69771531 -OEChem-04242411042D 81 83 0 1 0 0 0 0 0999 V2000 11.5263 1.5000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0263 2.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0263 0.6340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4641 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7942 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 2.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 2.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 2.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 3.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 4.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 4.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 3.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 2.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 0.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 0.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8723 -0.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2708 0.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5822 0.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1836 -0.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 0.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -0.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -2.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -1.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3363 2.9030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1742 -4.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4142 -4.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 18 1 0 0 0 0 2 17 2 0 0 0 0 3 20 2 0 0 0 0 4 68 1 0 0 0 0 5 69 1 0 0 0 0 16 7 1 6 0 0 0 7 20 1 0 0 0 0 7 53 1 0 0 0 0 8 17 1 0 0 0 0 8 24 1 0 0 0 0 8 61 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 39 1 0 0 0 0 10 13 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 14 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 16 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 15 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 52 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 54 1 0 0 0 0 19 21 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 23 25 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 26 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 26 29 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 30 1 0 0 0 0 27 70 1 0 0 0 0 28 31 2 0 0 0 0 28 71 1 0 0 0 0 29 33 2 0 0 0 0 29 34 1 0 0 0 0 30 32 2 0 0 0 0 30 72 1 0 0 0 0 31 32 1 0 0 0 0 31 73 1 0 0 0 0 32 35 1 0 0 0 0 33 36 1 0 0 0 0 33 74 1 0 0 0 0 34 37 2 0 0 0 0 34 75 1 0 0 0 0 35 76 1 0 0 0 0 35 77 1 0 0 0 0 35 78 1 0 0 0 0 36 38 2 0 0 0 0 36 79 1 0 0 0 0 37 38 1 0 0 0 0 37 80 1 0 0 0 0 38 81 1 0 0 0 0 M END > 69771531 > 1 > 752 > 5 > 4 > 14 > AAADcfB7OAIAAAAAAAAAAAAAAAAAAAAAAAAwYMAAAAAAAAABQAAAHggQCCAADSjJmAQyAILAABCIQiFSEIACAAAgAAAIiIGIAIgIYDKAkTGUIAAglgCIiAcYiMCOQAAAAAAAAACAAAAAAAAAAAAAAAAAAA== > [4-[[(1S)-1-(cyclohexylmethyl)-2-oxo-2-(2-phenylethylamino)ethyl]amino]-4-oxo-1-[2-(p-tolyl)ethyl]butyl]phosphonic acid > [6-[[(2S)-3-cyclohexyl-1-oxo-1-(2-phenylethylamino)propan-2-yl]amino]-1-(4-methylphenyl)-6-oxohexan-3-yl]phosphonic acid > [6-[[(2S)-3-cyclohexyl-1-oxo-1-(2-phenylethylamino)propan-2-yl]amino]-1-(4-methylphenyl)-6-oxohexan-3-yl]phosphonic acid > [6-[[(2S)-3-cyclohexyl-1-oxo-1-(2-phenylethylamino)propan-2-yl]amino]-1-(4-methylphenyl)-6-oxohexan-3-yl]phosphonic acid > [6-[[(2S)-3-cyclohexyl-1-oxidanylidene-1-(2-phenylethylamino)propan-2-yl]amino]-1-(4-methylphenyl)-6-oxidanylidene-hexan-3-yl]phosphonic acid > [4-[[(1S)-1-(cyclohexylmethyl)-2-keto-2-(phenethylamino)ethyl]amino]-4-keto-1-[2-(p-tolyl)ethyl]butyl]phosphonic acid > InChI=1S/C30H43N2O5P/c1-23-12-14-25(15-13-23)16-17-27(38(35,36)37)18-19-29(33)32-28(22-26-10-6-3-7-11-26)30(34)31-21-20-24-8-4-2-5-9-24/h2,4-5,8-9,12-15,26-28H,3,6-7,10-11,16-22H2,1H3,(H,31,34)(H,32,33)(H2,35,36,37)/t27?,28-/m0/s1 > VIUYMKRBEZXOKQ-CPRJBALCSA-N > 5.2 > 542.29095947 > C30H43N2O5P > 542.6 > CC1=CC=C(C=C1)CCC(CCC(=O)NC(CC2CCCCC2)C(=O)NCCC3=CC=CC=C3)P(=O)(O)O > CC1=CC=C(C=C1)CCC(CCC(=O)N[C@@H](CC2CCCCC2)C(=O)NCCC3=CC=CC=C3)P(=O)(O)O > 116 > 542.29095947 > 0 > 38 > 1 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 18 22 3 25 27 8 25 28 8 27 30 8 28 31 8 29 33 8 29 34 8 30 32 8 31 32 8 33 36 8 34 37 8 36 38 8 37 38 8 16 7 6 $$$$