70702037 -OEChem-05042416092D 76 79 0 0 0 0 0 0 0999 V2000 7.5797 -2.7688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.8152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0920 5.6812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0920 3.9492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8688 -3.9256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 4.0105 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8223 -6.5709 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.6512 2.3157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3191 3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9619 1.3651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2940 0.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6047 -0.3297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 4.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 5.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9368 -1.0740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 5.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 5.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2475 -2.0245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 5.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5920 4.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8903 -3.7193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2225 -4.4636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 5.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0920 5.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5332 -5.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5117 -5.6204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8653 -6.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 6.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1760 -7.1090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1545 -7.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 7.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8008 -6.7771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 6.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2687 2.8036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1043 2.0236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7016 2.5720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8660 3.3520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3444 0.8772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5088 1.6572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9115 1.1087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7471 0.3288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9872 -0.8176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1516 -0.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5543 -0.5861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3899 -1.3660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2010 6.2093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.1952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 6.4352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6301 -2.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7944 -1.7325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 4.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 4.8402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 4.8402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8399 -3.9757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6756 -4.7557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0920 5.0612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7120 5.6812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0920 6.3012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9257 -5.1589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2586 -6.0306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.6952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 7.1252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -7.5704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3471 -7.9045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 5.5052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 7.9352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 -7.3838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4075 -6.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9287 -6.1704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 7.1252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 25 1 0 0 0 0 2 21 1 0 0 0 0 2 24 1 0 0 0 0 3 23 1 0 0 0 0 3 28 1 0 0 0 0 4 23 2 0 0 0 0 5 25 2 0 0 0 0 6 9 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 7 30 1 0 0 0 0 7 35 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 16 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 15 2 0 0 0 0 13 18 1 0 0 0 0 14 17 2 0 0 0 0 14 23 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 52 1 0 0 0 0 18 22 2 0 0 0 0 18 53 1 0 0 0 0 19 21 2 0 0 0 0 19 54 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 22 57 1 0 0 0 0 24 27 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 26 29 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 32 2 0 0 0 0 27 33 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 30 65 1 0 0 0 0 31 34 2 0 0 0 0 31 66 1 0 0 0 0 32 36 1 0 0 0 0 32 67 1 0 0 0 0 33 37 2 0 0 0 0 33 68 1 0 0 0 0 34 35 1 0 0 0 0 34 69 1 0 0 0 0 35 70 1 0 0 0 0 36 39 2 0 0 0 0 36 71 1 0 0 0 0 37 39 1 0 0 0 0 37 72 1 0 0 0 0 38 73 1 0 0 0 0 38 74 1 0 0 0 0 38 75 1 0 0 0 0 39 76 1 0 0 0 0 M CHG 1 7 1 M END > 70702037 > 1 > 742 > 5 > 0 > 16 > AAADcfB/OAAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAFgB/AAAHgAAAAAADAzhngY+zvMMFACoAzT3TASCiCA3IiAI2CG+bNgOJvLEtbuHOSjkwBHY6Ye82bOeAEABAAACAAAAgAIAAAQAAAAAAAAAAA== > methyl 5-benzyloxy-1-[7-[2-(1-methylpyridin-1-ium-3-yl)acetyl]oxyheptyl]indole-2-carboxylate > 1-[7-[2-(1-methyl-3-pyridin-1-iumyl)-1-oxoethoxy]heptyl]-5-phenylmethoxy-2-indolecarboxylic acid methyl ester > methyl 1-[7-[2-(1-methylpyridin-1-ium-3-yl)acetyl]oxyheptyl]-5-phenylmethoxyindole-2-carboxylate > methyl 1-[7-[2-(1-methylpyridin-1-ium-3-yl)acetyl]oxyheptyl]-5-phenylmethoxyindole-2-carboxylate > methyl 1-[7-[2-(1-methylpyridin-1-ium-3-yl)ethanoyloxy]heptyl]-5-phenylmethoxy-indole-2-carboxylate > 5-benzoxy-1-[7-[2-(1-methylpyridin-1-ium-3-yl)acetyl]oxyheptyl]indole-2-carboxylic acid methyl ester > InChI=1S/C32H37N2O5/c1-33-17-11-14-26(23-33)20-31(35)38-19-10-5-3-4-9-18-34-29-16-15-28(39-24-25-12-7-6-8-13-25)21-27(29)22-30(34)32(36)37-2/h6-8,11-17,21-23H,3-5,9-10,18-20,24H2,1-2H3/q+1 > XQIQVUZCEKJPNU-UHFFFAOYSA-N > 6.1 > 529.27024729 > C32H37N2O5+ > 529.6 > C[N+]1=CC=CC(=C1)CC(=O)OCCCCCCCN2C3=C(C=C(C=C3)OCC4=CC=CC=C4)C=C2C(=O)OC > C[N+]1=CC=CC(=C1)CC(=O)OCCCCCCCN2C3=C(C=C(C=C3)OCC4=CC=CC=C4)C=C2C(=O)OC > 70.6 > 529.27024729 > 1 > 39 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 15 8 13 18 8 14 17 8 15 17 8 15 19 8 18 22 8 19 21 8 21 22 8 27 32 8 27 33 8 29 30 8 29 31 8 31 34 8 32 36 8 33 37 8 34 35 8 36 39 8 37 39 8 6 13 8 6 14 8 7 30 8 7 35 8 $$$$