71267782 -OEChem-03282405182D 46 49 0 1 0 0 0 0 0999 V2000 5.9405 -1.4396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4026 -1.9440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6844 -3.7018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6651 -2.6177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3692 3.5709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.6230 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.6783 -0.1817 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 1.4278 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.1322 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4026 -1.9422 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9917 -2.7502 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6750 3.2108 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9422 -2.4396 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3660 4.1619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 3.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 4.1619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7523 -3.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 2.9018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.6230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4266 -0.6931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 -2.4952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4309 -3.1879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 2.5984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4942 -2.1572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9725 4.2908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3012 4.7785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4906 3.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 2.6739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4308 4.7785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7596 4.2908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 -3.4574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0999 -3.5394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3350 2.3544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1147 2.5201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 0.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0935 -2.4815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 -4.1619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1674 -2.9812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9589 3.3793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 15 1 0 0 0 0 12 2 1 6 0 0 0 2 42 1 0 0 0 0 3 13 1 0 0 0 0 3 43 1 0 0 0 0 4 22 1 0 0 0 0 4 45 1 0 0 0 0 5 23 1 0 0 0 0 5 46 1 0 0 0 0 6 14 1 0 0 0 0 6 17 1 0 0 0 0 6 19 1 0 0 0 0 11 7 1 6 0 0 0 7 20 1 0 0 0 0 7 24 1 0 0 0 0 8 21 1 0 0 0 0 8 24 2 0 0 0 0 9 19 2 0 0 0 0 9 25 1 0 0 0 0 10 20 1 0 0 0 0 10 25 2 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 6 0 0 0 14 29 1 0 0 0 0 15 22 1 6 0 0 0 15 30 1 0 0 0 0 16 18 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 21 1 0 0 0 0 20 21 2 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 44 1 0 0 0 0 M END > 71267782 > 1 > 474 > 9 > 4 > 4 > AAADceBzuAAAAAAAAAAAAAAAAAAAAWLEgAAsAAAAAAAAAFgB+AAAHgAACAAACDzhlwYF8L8MFgCgAQZhZACAgC0REKABUCAoVBCDWAJAyEAeRAgPAALTACDwMAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (2R,4S,5R)-2-(hydroxymethyl)-5-[6-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]purin-9-yl]tetrahydrofuran-3,4-diol > (2R,4S,5R)-2-(hydroxymethyl)-5-[6-[(2R)-2-(hydroxymethyl)-1-pyrrolidinyl]-9-purinyl]oxolane-3,4-diol > (2R,4S,5R)-2-(hydroxymethyl)-5-[6-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]purin-9-yl]oxolane-3,4-diol > (2R,4S,5R)-2-(hydroxymethyl)-5-[6-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]purin-9-yl]oxolane-3,4-diol > (2R,4S,5R)-2-(hydroxymethyl)-5-[6-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]purin-9-yl]oxolane-3,4-diol > (2R,4S,5R)-2-methylol-5-[6-[(2R)-2-methylolpyrrolidino]purin-9-yl]tetrahydrofuran-3,4-diol > InChI=1S/C15H21N5O5/c21-4-8-2-1-3-19(8)13-10-14(17-6-16-13)20(7-18-10)15-12(24)11(23)9(5-22)25-15/h6-9,11-12,15,21-24H,1-5H2/t8-,9-,11?,12+,15-/m1/s1 > PFEYJMZLFBLZQX-HSOWGNGZSA-N > -0.4 > 351.15426879 > C15H21N5O5 > 351.36 > C1CC(N(C1)C2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)CO > C1C[C@@H](N(C1)C2=NC=NC3=C2N=CN3[C@H]4[C@H](C([C@H](O4)CO)O)O)CO > 137 > 351.15426879 > 0 > 25 > 4 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 20 8 10 25 8 14 23 6 15 22 6 19 21 8 12 2 6 20 21 8 13 3 3 11 7 6 7 20 8 7 24 8 8 21 8 8 24 8 9 19 8 9 25 8 $$$$