71537 -OEChem-05052415442D 76 78 0 1 0 0 0 0 0999 V2000 2.5657 5.0608 0.0000 I 0 5 0 0 0 0 0 0 0 0 0 0 0.0000 5.0608 0.0000 I 0 5 0 0 0 0 0 0 0 0 0 0 6.7300 1.3935 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6929 8.6317 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7460 2.4350 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6121 2.9350 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7460 4.4350 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6121 3.9350 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7300 5.4765 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8800 2.9350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 3.9350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5221 2.4282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5221 4.4418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6280 6.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7781 5.9971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6280 0.8657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6968 7.6317 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5301 1.3866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8063 2.0930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6364 7.0892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7613 7.0820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5301 5.4835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8678 4.9698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2200 0.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7432 1.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6929 8.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3802 9.5816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7430 8.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9982 9.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1870 10.1725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3449 3.3657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4789 4.8657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3449 3.5044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2694 3.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 2.3524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 4.5176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2694 3.8274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1337 2.3268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7266 3.0135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7266 3.8566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1337 4.5432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1656 6.0938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 5.4103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2271 0.3929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0253 0.3898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9582 8.0525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7436 0.8045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1401 1.4974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5943 2.6756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2237 1.8810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0184 1.5104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2464 6.9784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8499 7.6713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5433 7.6624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1522 6.9665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0682 5.7914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5537 5.5044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3333 4.6557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 4.4353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6867 0.8495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9038 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7533 0.2171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6426 1.8430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1314 1.1307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8438 0.6195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6305 8.0187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2998 8.5090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 10.1173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8148 9.3272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5492 8.9080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 8.1252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9369 7.7301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5656 9.3378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3062 10.1259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 10.6348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7703 10.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3 5 1 0 0 0 0 3 16 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 17 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 19 1 6 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 31 1 1 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 32 1 1 0 0 0 8 13 1 0 0 0 0 8 33 1 6 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 9 23 1 6 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 18 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 22 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 20 1 0 0 0 0 14 22 2 0 0 0 0 15 21 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 18 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 20 1 0 0 0 0 17 21 1 0 0 0 0 17 46 1 1 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 26 29 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 30 1 0 0 0 0 27 68 1 0 0 0 0 27 69 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 28 72 1 0 0 0 0 29 30 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 M CHG 4 1 -1 2 -1 3 1 4 1 M END > 71537 > 1 > 657 > 2 > 0 > 1 > AAADcfB7AAAAAwAAAAAAAAAAAAAAAWAAAAA8YIEAAAAAAACwAAAAHAAAAAAAD6jBAAQCAAMAAACAAiBCAAAAAAAgAAAACAAIAAgAAAIAgQAEAAAAgACIAAMQgMAPgAAAAAAAAACQAASAACQAAAAAAAAAAA== > (4aS,4bR,8S,10aR,10bS,12aS)-1,1,10a,12a-tetramethyl-8-(1-methylpyrrolidin-1-ium-1-yl)-3,4,4a,4b,5,7,8,9,10,10b,11,12-dodecahydro-2H-naphtho[2,1-f]quinolin-1-ium;diiodide > (4aS,4bR,8S,10aR,10bS,12aS)-1,1,10a,12a-tetramethyl-8-(1-methyl-1-pyrrolidin-1-iumyl)-3,4,4a,4b,5,7,8,9,10,10b,11,12-dodecahydro-2H-naphtho[2,1-f]quinolin-1-ium;diiodide > (4aS,4bR,8S,10aR,10bS,12aS)-1,1,10a,12a-tetramethyl-8-(1-methylpyrrolidin-1-ium-1-yl)-3,4,4a,4b,5,7,8,9,10,10b,11,12-dodecahydro-2H-naphtho[2,1-f]quinolin-1-ium;diiodide > (4aS,4bR,8S,10aR,10bS,12aS)-1,1,10a,12a-tetramethyl-8-(1-methylpyrrolidin-1-ium-1-yl)-3,4,4a,4b,5,7,8,9,10,10b,11,12-dodecahydro-2H-naphtho[2,1-f]quinolin-1-ium;diiodide > (4aS,4bR,8S,10aR,10bS,12aS)-1,1,10a,12a-tetramethyl-8-(1-methylpyrrolidin-1-ium-1-yl)-3,4,4a,4b,5,7,8,9,10,10b,11,12-dodecahydro-2H-naphtho[2,1-f]quinolin-1-ium;diiodide > (4aS,4bR,8S,10aR,10bS,12aS)-1,1,10a,12a-tetramethyl-8-(1-methylpyrrolidin-1-ium-1-yl)-3,4,4a,4b,5,7,8,9,10,10b,11,12-dodecahydro-2H-naphtho[2,1-f]quinolin-1-ium;diiodide > InChI=1S/C26H46N2.2HI/c1-25-14-12-21(28(5)17-6-7-18-28)19-20(25)10-11-22-23(25)13-15-26(2)24(22)9-8-16-27(26,3)4;;/h10,21-24H,6-9,11-19H2,1-5H3;2*1H/q+2;;/p-2/t21-,22+,23-,24-,25-,26-;;/m0../s1 > GGAGIPMNQXAXNH-XDMKMBKMSA-L > 640.17504 > C26H46I2N2 > 640.5 > CC12CCC(CC1=CCC3C2CCC4(C3CCC[N+]4(C)C)C)[N+]5(CCCC5)C.[I-].[I-] > C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC[N+]4(C)C)C)[N+]5(CCCC5)C.[I-].[I-] > 0 > 640.17504 > 0 > 30 > 6 > 0 > 0 > 0 > 0 > 3 > -1 > 1 5 255 > 17 46 5 5 19 6 6 31 5 7 32 5 8 33 6 9 23 6 $$$$