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0 0 0 0 0 0 0 -3.9023 -4.9919 1.0459 H 0 0 0 0 0 0 0 0 0 0 0 0 22 1 1 0 0 0 0 1 26 1 0 0 0 0 2 26 2 0 0 0 0 3 25 1 0 0 0 0 3 28 2 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 32 1 0 0 0 0 7 10 1 0 0 0 0 7 15 1 0 0 0 0 7 17 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 16 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 19 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 16 2 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 19 2 0 0 0 0 15 23 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 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 50 1 0 0 0 0 20 22 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 27 2 0 0 0 0 24 56 1 0 0 0 0 25 57 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 M END > 22 1 5 23 24 8 23 25 8 24 27 8 27 28 8 3 25 8 3 28 8 4 30 6 5 31 5 6 32 6 7 17 5 8 18 5 > InChI=1S/C26H33NO2/c1-17(28)29-20-10-12-25(2)19(15-20)6-7-21-23-9-8-22(18-5-4-14-27-16-18)26(23,3)13-11-24(21)25/h4-6,8,14,16,20-21,23-24H,7,9-13,15H2,1-3H3/t20-,21-,23-,24-,25-,26+/m0/s1 > UVIQSJCZCSLXRZ-UBUQANBQSA-N > 1/0/N:29,18,17,27,24,16,11,19,12,21,9,14,10,28,20,25,26,23,13,22,5,15,6,4,8,7,3,2,1/it:im/rA:62cOONCCCCCCCCCCCCCCCCCCCCCCCCCCHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;s4;s5;s6;s4;s4;s7s9;s5;s6;s8;s8;s7;s11d13;s7;s8;s12d15;s13;s14;s1s20s21;s15;s23;s3d23;s1d2;d24;d3s27;s26;s4;s5;s6;s9;s9;s10;s10;s11;s11;s12;s12;s14;s14;s16;s17;s17;s17;s18;s18;s18;s19;s20;s20;s21;s21;s22;s24;s25;s27;s28;s29;s29;s29;/rC:-3.2227,-4.6936,-1.4835;-3.7809,-6.6821,-1.6862;5.036,3.1424,2.9704;-.0687,-.4291,-.4433;-.5008,1.0296,-.8644;-.0508,2.058,.2341;1.5005,2.0946,.4735;-.5212,-1.537,-1.4876;1.4215,-.4679,.0406;1.7952,.6582,1.0385;-2.0143,1.0792,-1.223;-.4171,3.5508,.2337;-1.954,-1.3319,-1.8628;-.3272,-2.9951,-.8867;1.6471,3.2583,1.3685;-2.5841,-.1401,-1.7663;2.3494,2.4396,-.8108;.3248,-1.4548,-2.8075;.5619,4.0358,1.1787;-2.7302,-2.5167,-2.2589;-1.5701,-3.539,-.1401;-2.8543,-3.4806,-1.0358;2.7531,3.5703,2.2059;2.7492,4.6306,3.1563;3.9891,2.8684,2.1571;-3.6649,-5.7217,-.94;3.8497,4.9282,3.9857;5.0022,4.1362,3.8829;-4.0543,-5.8894,.4461;-.6422,-.6449,.4664;.0052,1.2916,-1.7944;-.5754,1.6961,1.135;1.6577,-1.4014,.5499;2.1019,-.416,-.809;2.8342,.486,1.2956;1.2511,.4935,1.9745;-2.197,1.8987,-1.9252;-2.5938,1.3021,-.3233;-.2842,4.0209,-.7432;-1.4409,3.7292,.5772;.5293,-3.0964,-.2248;-.1238,-3.7282,-1.6734;-3.539,-.0647,-2.0383;2.2166,1.7383,-1.6307;2.1038,3.4214,-1.2252;3.4199,2.447,-.6144;.2568,-.483,-3.2974;1.3808,-1.6605,-2.6262;.0093,-2.1919,-3.5495;.4065,4.9071,1.6271;-2.2239,-3.0139,-3.0902;-3.7337,-2.2983,-2.6381;-1.7225,-2.9351,.7589;-1.36,-4.5534,.2109;-3.6741,-3.078,-.4285;1.9346,5.2323,3.2793;4.1926,2.1246,1.5019;3.8197,5.7023,4.6518;5.8178,4.2989,4.4753;-5.1142,-6.1418,.5008;-3.4749,-6.6917,.9058;-3.9023,-4.9919,1.0459; > C26 H33 N O2 > 391.5457 > O(C(C([H])([H])[H])=O)[C@@]1([H])C([H])([H])C([H])([H])[C@@]2(C([H])([H])[H])C(C1([H])[H])=C([H])C([H])([H])[C@@]1([H])[C@]3([H])C([H])([H])C([H])=C(C4=C([H])N=C([H])C([H])=C4[H])[C@@]3(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]12[H] > 7997598 $$$$