68827616 -OEChem-05102405052D 59 62 0 1 0 0 0 0 0999 V2000 11.2774 -1.2965 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.3988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2774 -2.9059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3787 1.4921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5697 2.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0478 2.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5478 3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.1012 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8671 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8610 -2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8610 -2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4976 1.2796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0687 0.9551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8803 1.1276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5049 3.5099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9497 2.8933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4627 1.7744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5494 2.5996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1142 3.3534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3562 3.6909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3871 1.9814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9885 1.2911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 -2.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 -2.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.2212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 -0.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 0.4814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 0.9357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -0.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8610 -2.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4810 -2.1012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8610 -1.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 29 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 22 1 0 0 0 0 3 56 1 0 0 0 0 4 22 2 0 0 0 0 5 27 1 0 0 0 0 5 29 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 31 1 0 0 0 0 7 9 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 10 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 21 1 0 0 0 0 16 22 1 0 0 0 0 16 44 1 0 0 0 0 17 19 2 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 25 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 23 26 1 0 0 0 0 23 50 1 0 0 0 0 24 28 2 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 M END > 68827616 > 1 > 567 > 5 > 1 > 8 > AAADceB6MABAAAAAAAAAAAAAAAAAAeIAAAAwYAAAAAAAAFgB9AAAHgQACAAADQyh3gIyz7IIFgisAyTyTACD+KBhKjhImD02bJgMJrLksZuGeCjkwBHo6AeYyOCOqAACgAAIAQBQAAUAABACAAAAAAAAAA== > 2-[[4-(cyclopentylmethoxy)-3-(2-methyl-1,3-benzothiazol-6-yl)phenyl]methyl]butanoic acid > 2-[[4-(cyclopentylmethoxy)-3-(2-methyl-1,3-benzothiazol-6-yl)phenyl]methyl]butanoic acid > 2-[[4-(cyclopentylmethoxy)-3-(2-methyl-1,3-benzothiazol-6-yl)phenyl]methyl]butanoic acid > 2-[[4-(cyclopentylmethoxy)-3-(2-methyl-1,3-benzothiazol-6-yl)phenyl]methyl]butanoic acid > 2-[[4-(cyclopentylmethoxy)-3-(2-methyl-1,3-benzothiazol-6-yl)phenyl]methyl]butanoic acid > 2-[4-(cyclopentylmethoxy)-3-(2-methyl-1,3-benzothiazol-6-yl)benzyl]butyric acid > InChI=1S/C25H29NO3S/c1-3-19(25(27)28)12-18-8-11-23(29-15-17-6-4-5-7-17)21(13-18)20-9-10-22-24(14-20)30-16(2)26-22/h8-11,13-14,17,19H,3-7,12,15H2,1-2H3,(H,27,28) > DAQXZFGCFWBHGP-UHFFFAOYSA-N > 6.9 > 423.18681496 > C25H29NO3S > 423.6 > CCC(CC1=CC(=C(C=C1)OCC2CCCC2)C3=CC4=C(C=C3)N=C(S4)C)C(=O)O > CCC(CC1=CC(=C(C=C1)OCC2CCCC2)C3=CC4=C(C=C3)N=C(S4)C)C(=O)O > 87.7 > 423.18681496 > 0 > 30 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 26 8 1 29 8 12 13 8 12 17 8 13 18 8 15 18 8 15 19 8 16 21 3 17 19 8 20 23 8 20 24 8 23 26 8 24 28 8 26 27 8 27 28 8 5 27 8 5 29 8 $$$$