51750916 -OEChem-05092420382D 74 76 0 1 0 0 0 0 0999 V2000 3.8660 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8650 2.9863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8160 -0.7399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0343 -0.7710 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 2.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.8840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -0.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7320 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3149 -0.0764 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3301 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7533 0.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7436 0.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9172 -0.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1069 2.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1044 1.9463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4791 2.8735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7130 3.5163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3894 2.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 2.3060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 3.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8291 2.9260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 1.1940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 0.3470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 0.5740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 4.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1337 -0.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9033 1.4240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1707 1.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1234 1.7680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8702 1.0722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3621 0.7265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7652 1.3029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9480 -1.3850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1951 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 -0.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3291 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -1.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 1.4205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9781 -4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -4.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2181 -4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0806 3.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7563 4.1348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 2 0 0 0 0 2 19 2 0 0 0 0 3 27 1 0 0 0 0 3 35 1 0 0 0 0 4 24 2 0 0 0 0 5 8 1 0 0 0 0 5 17 1 0 0 0 0 5 38 1 0 0 0 0 16 6 1 1 0 0 0 6 19 1 0 0 0 0 6 22 1 0 0 0 0 7 18 1 0 0 0 0 7 24 1 0 0 0 0 7 62 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 54 1 0 0 0 0 18 19 1 6 0 0 0 18 21 1 0 0 0 0 18 55 1 0 0 0 0 20 25 2 0 0 0 0 20 26 1 0 0 0 0 21 23 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 27 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 23 24 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 25 28 1 0 0 0 0 25 31 1 0 0 0 0 26 29 2 0 0 0 0 26 63 1 0 0 0 0 27 32 2 0 0 0 0 28 30 2 0 0 0 0 28 64 1 0 0 0 0 29 30 1 0 0 0 0 29 65 1 0 0 0 0 30 33 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 34 1 0 0 0 0 32 69 1 0 0 0 0 33 70 1 0 0 0 0 33 71 1 0 0 0 0 33 72 1 0 0 0 0 34 35 2 0 0 0 0 34 73 1 0 0 0 0 35 74 1 0 0 0 0 M END > 51750916 > 1 > 775 > 4 > 2 > 9 > AAADcfB7OAAAAAAAAAAAAAAAAAAAAWJAAAAwAAAAAAAAAAABwAAAHgAQAAAADqzhmAYyBIPABECIAqlSkACCCAAkIAAIiIGODMgOZjKEtTuXOSjk1hGYqYecm8KPwAACAAAQAACAAAQAACAAAAAAAAAAAA== > (2S)-N-[(1S)-1-(2,4-dimethylphenyl)-2-oxo-2-(1,1,3,3-tetramethylbutylamino)ethyl]-N-(2-furylmethyl)-5-oxo-pyrrolidine-2-carboxamide > (2S)-N-[(1S)-1-(2,4-dimethylphenyl)-2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]-N-(2-furanylmethyl)-5-oxo-2-pyrrolidinecarboxamide > (2S)-N-[(1S)-1-(2,4-dimethylphenyl)-2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]-N-(furan-2-ylmethyl)-5-oxopyrrolidine-2-carboxamide > (2S)-N-[(1S)-1-(2,4-dimethylphenyl)-2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]-N-(furan-2-ylmethyl)-5-oxopyrrolidine-2-carboxamide > (2S)-N-[(1S)-1-(2,4-dimethylphenyl)-2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]-N-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidine-2-carboxamide > (2S)-N-[(1S)-1-(2,4-dimethylphenyl)-2-keto-2-(1,1,3,3-tetramethylbutylamino)ethyl]-N-(2-furfuryl)-5-keto-pyrrolidine-2-carboxamide > InChI=1S/C28H39N3O4/c1-18-10-11-21(19(2)15-18)24(25(33)30-28(6,7)17-27(3,4)5)31(16-20-9-8-14-35-20)26(34)22-12-13-23(32)29-22/h8-11,14-15,22,24H,12-13,16-17H2,1-7H3,(H,29,32)(H,30,33)/t22-,24-/m0/s1 > DSSKRPRLZSKBRU-UPVQGACJSA-N > 4.2 > 481.29405673 > C28H39N3O4 > 481.6 > CC1=CC(=C(C=C1)C(C(=O)NC(C)(C)CC(C)(C)C)N(CC2=CC=CO2)C(=O)C3CCC(=O)N3)C > CC1=CC(=C(C=C1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)N(CC2=CC=CO2)C(=O)[C@@H]3CCC(=O)N3)C > 91.6 > 481.29405673 > 0 > 35 > 2 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 18 19 6 20 25 8 20 26 8 25 28 8 26 29 8 27 32 8 28 30 8 29 30 8 3 27 8 3 35 8 32 34 8 34 35 8 16 6 5 $$$$