3035529 -OEChem-05132408142D 65 68 0 0 0 0 0 0 0999 V2000 11.5961 -0.0825 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.1320 -0.0825 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.9180 2.9625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 -0.6067 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -0.1100 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 0.3866 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 10.7301 -0.5826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4622 0.4174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0961 -0.9486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8641 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0961 0.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9981 -0.5826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3282 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5961 -1.8146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2660 -0.5826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1320 0.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2660 1.4175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 0.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2660 -1.5825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0420 1.4243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 2.4590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 -0.6172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 1.4521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0501 2.4659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1480 2.9867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1320 -2.0826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -2.0826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 0.9383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1320 -3.0826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -3.0826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2660 -3.5826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3316 -1.0575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1286 -1.0575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8607 0.8924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0636 0.8924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5711 -1.3471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5711 -0.5500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2626 0.3924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4656 0.3924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6331 1.0935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7861 1.3204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5592 0.4735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5995 -1.0575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3966 -1.0575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0182 -0.6195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8651 -0.3925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6382 0.4544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0592 -1.5046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2861 -2.3515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1331 -2.1246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5754 1.1081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7095 2.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5132 -1.2372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5132 2.0721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1456 3.6067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6690 -1.7726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8631 -1.7726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0642 1.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6690 -3.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8631 -3.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9204 3.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4538 2.6505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2660 -4.2025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 2 15 1 0 0 0 0 2 16 2 0 0 0 0 3 25 1 0 0 0 0 3 63 1 0 0 0 0 3 64 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 7 10 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 13 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 14 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 12 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 18 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 19 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 24 1 0 0 0 0 20 28 2 0 0 0 0 20 29 1 0 0 0 0 21 25 2 0 0 0 0 21 53 1 0 0 0 0 22 26 2 0 0 0 0 22 54 1 0 0 0 0 23 27 2 0 0 0 0 23 55 1 0 0 0 0 24 30 2 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 26 57 1 0 0 0 0 27 30 1 0 0 0 0 28 31 1 0 0 0 0 28 58 1 0 0 0 0 29 32 2 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 31 33 2 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 33 65 1 0 0 0 0 M CHG 4 1 1 2 1 5 1 6 -1 M END > 3035529 > 1 > 666 > 3 > 1 > 8 > AAADcfB7gAAAAAAAAAAAAAAAAAAAAAAAAAA8YMEAAAAAAACx/AAAHAAYAAAADAjBHgQywPNMEACiAyRiRACCgCAhAiAI2CA4ZJgIIOLA0dGEJAhgkADIyAcQgMAOiAAAQAQSAAAQAACACCQAAAAAAAAAAA== > 3-(3-amino-8-azido-6-phenyl-phenanthridin-5-ium-5-yl)propyl-diethyl-methyl-ammonium > 3-(3-amino-8-azido-6-phenyl-5-phenanthridin-5-iumyl)propyl-diethyl-methylammonium > 3-(3-amino-8-azido-6-phenylphenanthridin-5-ium-5-yl)propyl-diethyl-methylazanium > 3-(3-amino-8-azido-6-phenylphenanthridin-5-ium-5-yl)propyl-diethyl-methylazanium > 3-(3-azanyl-8-azido-6-phenyl-phenanthridin-5-ium-5-yl)propyl-diethyl-methyl-azanium > 3-(3-amino-8-azido-6-phenyl-phenanthridin-5-ium-5-yl)propyl-diethyl-methyl-ammonium > InChI=1S/C27H31N6/c1-4-33(3,5-2)17-9-16-32-26-18-21(28)12-14-24(26)23-15-13-22(30-31-29)19-25(23)27(32)20-10-7-6-8-11-20/h6-8,10-15,18-19,28H,4-5,9,16-17H2,1-3H3/q+1/p+1 > DXHWIAMGTKXUEA-UHFFFAOYSA-O > 6.6 > 440.26884505 > C27H32N6+2 > 440.6 > CC[N+](C)(CC)CCC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N=[N+]=[N-])N > CC[N+](C)(CC)CCC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N=[N+]=[N-])N > 44.3 > 440.26884505 > 2 > 33 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 15 18 8 16 17 8 16 21 8 17 19 8 17 22 8 18 19 8 18 23 8 19 24 8 2 15 8 2 16 8 20 28 8 20 29 8 21 25 8 22 26 8 23 27 8 24 30 8 25 26 8 27 30 8 28 31 8 29 32 8 31 33 8 32 33 8 $$$$