11281011 -OEChem-03282412582D 53 53 0 1 0 0 0 0 0999 V2000 5.1350 -5.2500 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0010 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4651 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2131 -1.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6116 -0.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 -0.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 -0.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7751 1.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1551 2.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9791 0.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2191 0.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 5.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7751 4.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1551 5.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0431 5.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4231 4.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 14 2 1 6 0 0 0 2 19 1 0 0 0 0 3 14 1 0 0 0 0 3 22 1 0 0 0 0 4 21 1 0 0 0 0 4 53 1 0 0 0 0 5 19 2 0 0 0 0 6 21 2 0 0 0 0 7 22 2 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 1 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 11 31 1 0 0 0 0 12 21 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 34 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 23 1 0 0 0 0 17 42 1 0 0 0 0 18 24 2 0 0 0 0 18 43 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 20 27 1 0 0 0 0 20 44 1 0 0 0 0 23 25 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END > 11281011 > 1 > 502 > 6 > 2 > 11 > AAADceB6OAAEAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAHgIQCAAADQLxmCcyCILABgCIAiDSGAACAAAgBQAIiIEIAokYIDKBkxGuYAAklgAMiAe8yOCOhAAAAAAAAAAIAAAAAAAAAAAAAAAAAA== > (3R)-3-(4-chlorophenyl)-4-[[(1S)-2-methyl-1-(2-methylpropanoyloxy)propoxy]carbonylamino]butanoic acid > (3R)-3-(4-chlorophenyl)-4-[[[(1S)-2-methyl-1-(2-methyl-1-oxopropoxy)propoxy]-oxomethyl]amino]butanoic acid > (3R)-3-(4-chlorophenyl)-4-[[(1S)-2-methyl-1-(2-methylpropanoyloxy)propoxy]carbonylamino]butanoic acid > (3R)-3-(4-chlorophenyl)-4-[[(1S)-2-methyl-1-(2-methylpropanoyloxy)propoxy]carbonylamino]butanoic acid > (3R)-3-(4-chlorophenyl)-4-[[(1S)-2-methyl-1-(2-methylpropanoyloxy)propoxy]carbonylamino]butanoic acid > (3R)-3-(4-chlorophenyl)-4-[[(1S)-1-isobutyryloxy-2-methyl-propoxy]carbonylamino]butyric acid > InChI=1S/C19H26ClNO6/c1-11(2)17(24)26-18(12(3)4)27-19(25)21-10-14(9-16(22)23)13-5-7-15(20)8-6-13/h5-8,11-12,14,18H,9-10H2,1-4H3,(H,21,25)(H,22,23)/t14-,18-/m0/s1 > JXTAALBWJQJLGN-KSSFIOAISA-N > 4.2 > 399.1448652 > C19H26ClNO6 > 399.9 > CC(C)C(OC(=O)C(C)C)OC(=O)NCC(CC(=O)O)C1=CC=C(C=C1)Cl > CC(C)[C@@H](OC(=O)C(C)C)OC(=O)NC[C@H](CC(=O)O)C1=CC=C(C=C1)Cl > 102 > 399.1448652 > 0 > 27 > 2 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 17 8 13 18 8 17 23 8 18 24 8 14 2 6 23 25 8 24 25 8 9 10 5 $$$$