24825429 -OEChem-03182422142D 72 75 0 1 0 0 0 0 0999 V2000 10.5388 1.4010 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5388 0.4010 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.5388 -0.5990 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.4851 0.7057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4851 -0.9038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5878 -0.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5878 0.7100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0687 -0.0990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -0.0990 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2788 1.6610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4049 1.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.7670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -0.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9479 2.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3006 1.8689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4049 2.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2709 1.4010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -1.8311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6389 3.3552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9916 2.8200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -1.8311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6607 3.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2709 3.4010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1369 1.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1369 2.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -2.6971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.6971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5399 -1.4490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0224 1.0149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2340 1.2726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2340 -1.4707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0224 -1.2130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0508 -1.2181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8400 -1.4745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5295 -0.5138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5295 0.3157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0019 1.7110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3100 0.4379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3923 -1.5756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0826 -1.1771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0369 1.0770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1900 1.3039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9631 0.4570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6077 -0.3545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9174 -0.7530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5544 2.2753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8858 1.4082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8679 3.2110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2709 0.7810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8923 -2.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5826 -2.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0537 3.8160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3852 2.9489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1077 -1.2205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4174 -1.6190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4691 4.1528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2709 4.0210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6739 1.5910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6739 3.2110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3923 -3.3077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0826 -2.9092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6077 -2.0865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9174 -2.4851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8923 -4.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5826 -3.7752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -3.5631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.1831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 0 1 13 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 32 1 1 0 0 0 4 8 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 8 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 9 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 10 42 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 15 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 20 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 21 1 0 0 0 0 16 50 1 0 0 0 0 17 22 2 0 0 0 0 17 51 1 0 0 0 0 18 25 1 0 0 0 0 18 52 1 0 0 0 0 19 26 2 0 0 0 0 19 53 1 0 0 0 0 20 23 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 24 2 0 0 0 0 21 56 1 0 0 0 0 22 24 1 0 0 0 0 22 57 1 0 0 0 0 23 28 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 25 27 2 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 26 62 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 30 1 0 0 0 0 29 66 1 0 0 0 0 29 67 1 0 0 0 0 30 31 1 0 0 0 0 30 68 1 0 0 0 0 30 69 1 0 0 0 0 31 70 1 0 0 0 0 31 71 1 0 0 0 0 31 72 1 0 0 0 0 M END > 24825429 > 1 > 565 > 1 > 1 > 11 > AAADcfB6AAAAAAAAAAAAAAAAAAAAAYIAAAAwYAAAAAAQAAABQAAAHAAQAAAADYiBGAAywILAAACAAiRCQACCAAAhAgAIiAAAZIgIICLAkZGEIAhgkADIyAcQgMAOgAAAAAAAAAAAAAAAAAAAAAAACQAAAA== > (3aS,6aR)-5-(1-methylnonyl)-N,4-diphenyl-2,3,6,6a-tetrahydro-1H-pentalen-3a-amine > (3aS,6aR)-5-decan-2-yl-N,4-diphenyl-2,3,6,6a-tetrahydro-1H-pentalen-3a-amine > (3aS,6aR)-5-decan-2-yl-N,4-diphenyl-2,3,6,6a-tetrahydro-1H-pentalen-3a-amine > (3aS,6aR)-5-decan-2-yl-N,4-diphenyl-2,3,6,6a-tetrahydro-1H-pentalen-3a-amine > (3aS,6aR)-5-decan-2-yl-N,4-diphenyl-2,3,6,6a-tetrahydro-1H-pentalen-3a-amine > [(3aS,6aR)-5-(1-methylnonyl)-4-phenyl-2,3,6,6a-tetrahydro-1H-pentalen-3a-yl]-phenyl-amine > InChI=1S/C30H41N/c1-3-4-5-6-7-10-16-24(2)28-23-26-19-15-22-30(26,31-27-20-13-9-14-21-27)29(28)25-17-11-8-12-18-25/h8-9,11-14,17-18,20-21,24,26,31H,3-7,10,15-16,19,22-23H2,1-2H3/t24?,26-,30+/m1/s1 > YDRMRYPPHSNJNC-RVNDPTKZSA-N > 9.2 > 415.323900312 > C30H41N > 415.7 > CCCCCCCCC(C)C1=C(C2(CCCC2C1)NC3=CC=CC=C3)C4=CC=CC=C4 > CCCCCCCCC(C)C1=C([C@@]2(CCC[C@@H]2C1)NC3=CC=CC=C3)C4=CC=CC=C4 > 12 > 415.323900312 > 0 > 31 > 2 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 2 1 5 10 14 3 11 16 8 11 17 8 13 18 8 13 19 8 16 21 8 17 22 8 18 25 8 19 26 8 21 24 8 22 24 8 25 27 8 26 27 8 3 32 5 $$$$