6480442 -OEChem-04202011373D 70 72 0 0 0 0 0 0 0999 V2000 0.5823 -2.2964 1.2915 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.9175 -1.8646 0.9409 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9184 -0.7747 0.8529 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -3.1375 0.5518 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4916 -2.5112 2.7746 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9072 1.5419 1.3394 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8181 -1.7406 -1.0593 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0066 2.6863 1.9082 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5457 -2.6543 0.1552 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7994 -0.4936 -0.8082 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4956 1.6230 -0.7364 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6212 -0.1813 -1.8367 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 2.1750 -2.3055 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3791 0.5182 -2.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2563 -2.3675 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5830 -3.7287 1.2183 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1686 -2.5059 1.8613 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8159 -1.9485 -0.6292 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9059 -2.7011 0.3962 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7942 0.2536 -1.3528 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7989 0.3734 -0.4533 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2454 1.5628 -1.2989 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3943 2.5425 -1.8003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8847 0.8554 -2.2923 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2128 0.2915 1.4712 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0157 -2.9086 -0.8254 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0413 3.9202 1.4062 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 -0.4402 -0.8455 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1757 2.6694 1.5877 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0695 -1.7426 -0.5103 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2337 3.8608 2.3702 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1965 5.1726 1.6755 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5678 3.9739 -0.0371 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -0.3146 -2.3674 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2008 -0.4599 -0.2059 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0149 0.7512 -0.2853 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8559 -4.2746 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2499 -4.3649 0.6482 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2288 -2.3277 1.7284 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7892 -2.2160 2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8577 -2.2669 -0.7587 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2446 -2.3807 -1.4587 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1155 -3.7646 0.5347 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -2.4968 -0.6721 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7189 0.0389 0.0063 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6297 3.5986 -1.8138 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0924 0.0840 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7686 0.3702 0.9976 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0952 -2.8014 -1.4003 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5386 -3.7841 -1.2262 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6723 -0.4490 -2.8383 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 1.2503 -3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8432 4.7688 2.3024 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8929 3.7606 3.4071 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8871 3.0067 2.1595 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7881 6.0860 1.5479 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6599 5.2300 0.9936 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1982 5.1712 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1534 4.8834 -0.2119 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2092 3.1185 -0.2693 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 3.9622 -0.7561 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5283 0.5787 -2.6369 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4687 -1.1874 -2.7855 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 -0.2436 -2.8649 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7526 0.4607 -0.4269 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1372 -0.5580 0.8841 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7955 -1.3032 -0.5758 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5463 1.6944 -0.4538 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8494 0.6429 0.7928 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0304 0.8370 -0.7581 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 5 2 0 0 0 0 1 19 1 0 0 0 0 2 15 1 0 0 0 0 2 19 1 0 0 0 0 3 25 1 0 0 0 0 4 26 1 0 0 0 0 6 25 1 0 0 0 0 6 29 1 0 0 0 0 7 26 1 0 0 0 0 7 30 1 0 0 0 0 8 29 2 0 0 0 0 9 30 2 0 0 0 0 10 18 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 11 21 2 0 0 0 0 11 22 1 0 0 0 0 12 20 2 0 0 0 0 12 24 1 0 0 0 0 13 23 1 0 0 0 0 13 24 2 0 0 0 0 14 24 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 23 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 29 1 0 0 0 0 27 31 1 0 0 0 0 27 32 1 0 0 0 0 27 33 1 0 0 0 0 28 30 1 0 0 0 0 28 34 1 0 0 0 0 28 35 1 0 0 0 0 28 36 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 36 68 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 M END > DB05020 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/JLKJXDOWBVVABZ-UHFFFAOYSA-N/SDF?record_type=3d > CC(C)(C)C(=O)OCOP(=O)(COC1(CN2C=NC3=CN=C(N)N=C23)CC1)OCOC(=O)C(C)(C)C > InChI=1S/C22H34N5O8P/c1-20(2,3)17(28)31-12-34-36(30,35-13-32-18(29)21(4,5)6)14-33-22(7-8-22)10-27-11-25-15-9-24-19(23)26-16(15)27/h9,11H,7-8,10,12-14H2,1-6H3,(H2,23,24,26) > JLKJXDOWBVVABZ-UHFFFAOYSA-N > C22H34N5O8P > 527.515 > 527.214500073 > 8 > 70 > 0.0037594025881941932 > 53.298493878874154 > 0 > 1 > 0 > 0 > {[({1-[(2-amino-9H-purin-9-yl)methyl]cyclopropoxy}methyl)({[(2,2-dimethylpropanoyl)oxy]methoxy})phosphoryl]oxy}methyl 2,2-dimethylpropanoate > 1.39 > 3.340204853999998 > -2.85 > 1 > 0 > 3 > 0 > 16.67093678795387 > 3.5777685961257495 > 166.98 > 126.7255 > 15 > 0 > 7.44e-01 g/l > (argentiooxy)silver > 0 $$$$