67853010 -OEChem-05062414222D 69 72 0 1 0 0 0 0 0999 V2000 8.9030 1.8986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 -4.7502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 -3.0554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 1.8181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.4862 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -2.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -2.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -3.5935 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7320 -1.1815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 -4.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -3.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 1.0738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 -5.2883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2136 2.8492 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5458 3.5935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 1.2800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8564 4.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1921 3.0554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 1.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 0.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 2.2305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 0.7419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 2.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1886 5.2883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5028 4.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8600 2.3111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4813 4.2121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8385 2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1491 3.4678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5812 -2.5556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -2.0233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 -2.5241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 -3.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6714 -3.4656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2277 -3.8499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0633 -4.6298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -0.6815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.9385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3316 -5.4809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1135 -5.8776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5102 -5.0957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6277 2.3877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9988 3.8855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1632 3.1056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.4915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.1285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4034 4.2520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2390 5.0319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4427 -0.0536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 2.6920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0279 0.2804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4492 3.0260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1739 -4.8781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6501 5.7024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7745 5.7498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7271 4.8742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0887 4.4674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6674 1.7218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6739 4.8014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2525 2.0558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7558 3.5957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 26 1 0 0 0 0 2 15 1 0 0 0 0 2 61 1 0 0 0 0 3 15 2 0 0 0 0 4 17 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 11 1 0 0 0 0 8 15 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 12 1 0 0 0 0 10 16 2 0 0 0 0 11 18 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 44 1 0 0 0 0 14 21 1 0 0 0 0 14 45 1 0 0 0 0 16 22 1 0 0 0 0 16 46 1 0 0 0 0 17 23 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 19 50 1 0 0 0 0 20 24 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 21 53 1 0 0 0 0 22 54 1 0 0 0 0 23 27 2 0 0 0 0 23 28 1 0 0 0 0 24 31 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 32 2 0 0 0 0 25 33 1 0 0 0 0 26 29 2 0 0 0 0 26 30 1 0 0 0 0 27 29 1 0 0 0 0 27 57 1 0 0 0 0 28 30 2 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 32 34 1 0 0 0 0 32 65 1 0 0 0 0 33 35 2 0 0 0 0 33 66 1 0 0 0 0 34 36 2 0 0 0 0 34 67 1 0 0 0 0 35 36 1 0 0 0 0 35 68 1 0 0 0 0 36 69 1 0 0 0 0 M END > 67853010 > 1 > 697 > 4 > 1 > 12 > AAADcfB6OAAAAAAAAAAAAAAAAAAAAWAAAAAwYMAAAAAAAFgB9AAAHgAACAAADRzhngY+zvMMFgCoA7T3TACCiCA1IiAI2CE+bNgMJvrEtZuGeajkwBHI6ce8zODOoAAAAAACAABAAAAAAAQAAAAAAAAAAA== > 2-ethyl-4-[3-[4-(1-phenylbutoxy)benzoyl]indol-1-yl]butanoic acid > 2-ethyl-4-[3-[oxo-[4-(1-phenylbutoxy)phenyl]methyl]-1-indolyl]butanoic acid > 2-ethyl-4-[3-[4-(1-phenylbutoxy)benzoyl]indol-1-yl]butanoic acid > 2-ethyl-4-[3-[4-(1-phenylbutoxy)benzoyl]indol-1-yl]butanoic acid > 2-ethyl-4-[3-[4-(1-phenylbutoxy)phenyl]carbonylindol-1-yl]butanoic acid > 2-ethyl-4-[3-[4-(1-phenylbutoxy)benzoyl]indol-1-yl]butyric acid > InChI=1S/C31H33NO4/c1-3-10-29(23-11-6-5-7-12-23)36-25-17-15-24(16-18-25)30(33)27-21-32(20-19-22(4-2)31(34)35)28-14-9-8-13-26(27)28/h5-9,11-18,21-22,29H,3-4,10,19-20H2,1-2H3,(H,34,35) > XYKSLDYLGJFTRN-UHFFFAOYSA-N > 6.8 > 483.24095853 > C31H33NO4 > 483.6 > CCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(=O)C3=CN(C4=CC=CC=C43)CCC(CC)C(=O)O > CCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(=O)C3=CN(C4=CC=CC=C43)CCC(CC)C(=O)O > 68.5 > 483.24095853 > 0 > 36 > 0 > 2 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 12 8 10 16 8 12 13 8 14 21 8 16 22 8 19 20 3 21 22 8 23 27 8 23 28 8 25 32 8 25 33 8 26 29 8 26 30 8 27 29 8 28 30 8 32 34 8 33 35 8 34 36 8 35 36 8 5 13 8 5 9 8 8 11 3 9 10 8 9 14 8 $$$$