49795224 -OEChem-04162405422D 67 72 0 1 0 0 0 0 0999 V2000 6.8335 -0.2373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7905 0.1752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4978 1.2513 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.5443 -1.3940 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -3.0035 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.1988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -7.6988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -0.4435 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1871 0.3008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1441 0.7132 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4763 1.4575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8299 1.9956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1226 0.9195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1406 2.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -2.1988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4727 3.6904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1191 3.1524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7834 4.6410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4298 4.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7619 4.8472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0726 5.7977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0511 6.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4047 6.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3618 6.9544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7154 7.4925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -6.1988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.1988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6939 7.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -7.1988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -7.1988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2690 -0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6402 0.5928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8046 -0.1871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5582 0.2518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0026 1.7852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2450 2.0328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 2.2877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4474 1.5077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6490 1.2471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8914 1.4947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7479 -2.1988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8661 3.5626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5332 2.6909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3972 0.3030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3694 5.1024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0364 4.2307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.3888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.5088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -4.1161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -4.8064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4652 5.5425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7981 6.4142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9684 7.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3013 7.9540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.8888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.8888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8865 8.2881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -7.5088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -7.5088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 2 15 1 0 0 0 0 2 52 1 0 0 0 0 3 11 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 10 4 1 1 0 0 0 4 16 1 0 0 0 0 4 18 1 0 0 0 0 5 18 2 0 0 0 0 5 19 1 0 0 0 0 6 16 2 0 0 0 0 6 26 1 0 0 0 0 7 22 1 0 0 0 0 7 28 1 0 0 0 0 7 56 1 0 0 0 0 8 22 1 0 0 0 0 8 26 2 0 0 0 0 9 37 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 1 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 17 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 19 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 18 49 1 0 0 0 0 19 22 2 0 0 0 0 20 23 1 0 0 0 0 20 50 1 0 0 0 0 21 24 2 0 0 0 0 21 51 1 0 0 0 0 23 25 2 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 27 1 0 0 0 0 26 55 1 0 0 0 0 27 30 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 34 2 0 0 0 0 29 35 1 0 0 0 0 30 32 1 0 0 0 0 30 59 1 0 0 0 0 31 33 2 0 0 0 0 31 60 1 0 0 0 0 32 36 2 0 0 0 0 32 61 1 0 0 0 0 33 36 1 0 0 0 0 33 62 1 0 0 0 0 34 37 1 0 0 0 0 34 63 1 0 0 0 0 35 38 2 0 0 0 0 35 64 1 0 0 0 0 36 65 1 0 0 0 0 37 66 1 0 0 0 0 38 67 1 0 0 0 0 M END > 49795224 > 1 > 711 > 8 > 2 > 8 > AAADceB7sAAAAAAAAAAAAAAAAAAAAWAAAAA8eLECAAAAAFgB/gAAHgAQCAAADBzhnwY98L/MFgCgAzZnZACCgC0xEqAJ2KA4dJiLeGLA2dGfZAhqgALbyCcQgMAOwAAAAAAAAACAAAAAAAAAAAAAAAAAAA== > [(2S,6R)-4-[(4-phenylphenyl)methyl]-6-[6-(4-pyridylmethylamino)purin-9-yl]morpholin-2-yl]methanol > [(2S,6R)-4-[(4-phenylphenyl)methyl]-6-[6-(pyridin-4-ylmethylamino)-9-purinyl]-2-morpholinyl]methanol > [(2S,6R)-4-[(4-phenylphenyl)methyl]-6-[6-(pyridin-4-ylmethylamino)purin-9-yl]morpholin-2-yl]methanol > [(2S,6R)-4-[(4-phenylphenyl)methyl]-6-[6-(pyridin-4-ylmethylamino)purin-9-yl]morpholin-2-yl]methanol > [(2S,6R)-4-[(4-phenylphenyl)methyl]-6-[6-(pyridin-4-ylmethylamino)purin-9-yl]morpholin-2-yl]methanol > [(2S,6R)-4-(4-phenylbenzyl)-6-[6-(4-pyridylmethylamino)purin-9-yl]morpholin-2-yl]methanol > InChI=1S/C29H29N7O2/c37-18-25-16-35(15-22-6-8-24(9-7-22)23-4-2-1-3-5-23)17-26(38-25)36-20-34-27-28(32-19-33-29(27)36)31-14-21-10-12-30-13-11-21/h1-13,19-20,25-26,37H,14-18H2,(H,31,32,33)/t25-,26+/m0/s1 > CFPVTWLZSXKODX-IZZNHLLZSA-N > 3 > 507.23827319 > C29H29N7O2 > 507.6 > C1C(OC(CN1CC2=CC=C(C=C2)C3=CC=CC=C3)N4C=NC5=C(N=CN=C54)NCC6=CC=NC=C6)CO > C1[C@H](O[C@H](CN1CC2=CC=C(C=C2)C3=CC=CC=C3)N4C=NC5=C(N=CN=C54)NCC6=CC=NC=C6)CO > 101 > 507.23827319 > 0 > 38 > 2 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 15 5 16 19 8 17 20 8 17 21 8 19 22 8 20 23 8 21 24 8 23 25 8 24 25 8 27 30 8 27 31 8 29 34 8 29 35 8 30 32 8 31 33 8 32 36 8 33 36 8 34 37 8 35 38 8 10 4 5 4 16 8 4 18 8 5 18 8 5 19 8 6 16 8 6 26 8 8 22 8 8 26 8 9 37 8 9 38 8 $$$$