122021 -OEChem-10191521222D 70 72 0 1 0 0 0 0 0999 V2000 2.0000 -0.0384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 1.6935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9595 3.1253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1475 -4.0938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4533 -4.4539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4616 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9616 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 2.6641 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5384 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0000 -3.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5116 1.0549 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7195 0.0767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.7980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6706 -0.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 2.4562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8785 -1.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0875 3.5776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8296 -1.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0375 -2.4976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 3.6821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9885 -2.8066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6698 2.8731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4888 4.5957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6643 2.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4833 4.7002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1964 -3.7848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0710 3.8912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.2284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.4558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -2.1460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.1460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -1.4558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -2.9307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -3.6210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -3.6210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.9307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -4.0133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -4.0133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -0.6210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 0.0693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0298 0.6647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.2716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0999 0.0551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6332 -0.5372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2902 -0.2106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7569 0.3817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2589 -1.2320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7922 -1.8244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1307 4.1961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4859 3.7276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4492 -1.4978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9158 -0.9055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4178 -2.5192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9512 -3.1115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6082 -2.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0748 -2.1926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4176 2.3067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1243 5.0973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0287 2.4761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7354 5.2666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6877 3.9560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2764 -4.7002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 52 1 0 0 0 0 2 19 2 0 0 0 0 3 21 2 0 0 0 0 4 32 1 0 0 0 0 4 70 1 0 0 0 0 5 32 2 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 6 21 1 0 0 0 0 7 16 1 0 0 0 0 7 49 1 0 0 0 0 8 19 1 0 0 0 0 8 21 1 0 0 0 0 8 23 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 34 1 0 0 0 0 10 13 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 14 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 16 1 0 0 0 0 12 39 1 0 0 0 0 13 15 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 48 1 0 0 0 0 18 20 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 20 22 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 22 24 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 26 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 27 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 27 32 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 28 30 1 0 0 0 0 28 65 1 0 0 0 0 29 31 2 0 0 0 0 29 66 1 0 0 0 0 30 33 2 0 0 0 0 30 67 1 0 0 0 0 31 33 1 0 0 0 0 31 68 1 0 0 0 0 33 69 1 0 0 0 0 M END > 122021 > 1 > 646 > 6 > 3 > 13 > AAADcfB7OAAAAAAAAAAAAAAAAAAAAWAAAAAwYAAAAAAAAAABAAAAHgAYCAAADTzhmAYxCINiAgCIAiHSGACCAAAgAAAeqIGIBIiKcDKAkTGUYAhslyKIiAeYyKCOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > 7-[1-benzyl-3-[(2-cyclohexyl-2-hydroxy-ethyl)amino]-2,5-dioxo-imidazolidin-4-yl]heptanoic acid > 7-[3-[(2-cyclohexyl-2-hydroxyethyl)amino]-2,5-dioxo-1-(phenylmethyl)-4-imidazolidinyl]heptanoic acid > 7-[1-benzyl-3-[(2-cyclohexyl-2-hydroxyethyl)amino]-2,5-dioxoimidazolidin-4-yl]heptanoic acid > 7-[3-[(2-cyclohexyl-2-oxidanyl-ethyl)amino]-2,5-bis(oxidanylidene)-1-(phenylmethyl)imidazolidin-4-yl]heptanoic acid > 7-[1-benzyl-3-[(2-cyclohexyl-2-hydroxy-ethyl)amino]-2,5-diketo-imidazolidin-4-yl]enanthic acid > InChI=1S/C25H37N3O5/c29-22(20-13-7-4-8-14-20)17-26-28-21(15-9-1-2-10-16-23(30)31)24(32)27(25(28)33)18-19-11-5-3-6-12-19/h3,5-6,11-12,20-22,26,29H,1-2,4,7-10,13-18H2,(H,30,31) > YZJVWSKJHGEIBL-UHFFFAOYSA-N > 1.7 > 459.273321 > C25H37N3O5 > 459.57838 > C1CCC(CC1)C(CNN2C(C(=O)N(C2=O)CC3=CC=CC=C3)CCCCCCC(=O)O)O > C1CCC(CC1)C(CNN2C(C(=O)N(C2=O)CC3=CC=CC=C3)CCCCCCC(=O)O)O > 110 > 459.273321 > 0 > 33 > 0 > 2 > 0 > 0 > 0 > 1 > 2 > 1 5 255 > 12 1 3 17 18 3 26 28 8 26 29 8 28 30 8 29 31 8 30 33 8 31 33 8 $$$$