448873 -OEChem-12061917593D 60 62 0 1 0 0 0 0 0999 V2000 2.9919 -1.8089 -1.4404 P 0 0 1 0 0 0 0 0 0 0 0 0 1.8438 -2.9153 1.0326 P 0 0 2 0 0 0 0 0 0 0 0 0 -2.9319 -1.6422 1.2758 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4425 0.8182 0.5113 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1185 -3.8413 -0.7536 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8563 -1.6165 -2.3092 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0078 -0.2926 -0.8842 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2993 -3.3268 1.2815 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8376 3.9037 -1.8868 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5282 3.8098 0.9444 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6075 2.2659 -1.8268 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8763 -2.5614 -0.5443 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 0.7186 3.2245 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9000 0.8203 -1.3609 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2893 -1.7015 -2.8937 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -4.3226 1.1058 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3326 -2.4846 -1.4491 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3825 -1.8363 1.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8064 4.4182 0.6183 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1757 0.3962 0.1577 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8557 2.6107 -0.3748 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0267 -2.9681 -0.4659 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3053 -1.5824 -1.0086 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0047 -2.7237 1.0368 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2742 -1.0292 0.0221 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8778 2.7122 -1.1060 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5076 3.0143 0.3473 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9114 1.6931 -1.7119 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3706 1.7073 1.1384 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7964 0.4528 -0.8271 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6378 -2.3007 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8685 1.9620 2.5569 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0393 1.2373 -0.5829 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2322 0.9479 1.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0692 2.2592 1.2043 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9306 3.2065 0.4684 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1224 -3.4192 -0.8832 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3747 -1.0040 -1.0422 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3552 -3.6021 1.5905 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3085 -1.3039 -0.2179 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9067 2.3347 -1.1531 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5777 3.5940 0.3807 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2449 1.4301 -2.7224 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3389 1.1948 1.2148 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9685 -0.1671 -1.1866 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6723 -2.1248 2.6382 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3023 -1.3723 1.0884 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5594 2.5990 3.1172 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8798 2.4283 2.5463 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 -4.7064 -0.3615 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -0.7032 -2.5545 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5956 0.2737 1.5701 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0842 3.6666 -2.7971 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3587 3.3046 0.9174 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 1.6075 -2.2535 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4654 3.2339 -0.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3302 2.6565 1.8872 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4268 0.9028 4.1211 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.4874 -3.4805 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3521 -5.0588 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 12 1 0 0 0 0 1 15 1 0 0 0 0 1 17 2 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 2 16 1 0 0 0 0 2 18 2 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 22 1 0 0 0 0 5 50 1 0 0 0 0 6 23 1 0 0 0 0 6 51 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 9 26 1 0 0 0 0 9 53 1 0 0 0 0 10 27 1 0 0 0 0 10 54 1 0 0 0 0 11 28 1 0 0 0 0 11 55 1 0 0 0 0 13 32 1 0 0 0 0 13 58 1 0 0 0 0 14 33 2 0 0 0 0 15 59 1 0 0 0 0 16 60 1 0 0 0 0 19 36 2 0 0 0 0 20 25 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 33 1 0 0 0 0 21 36 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 37 1 0 0 0 0 23 25 1 0 0 0 0 23 38 1 0 0 0 0 24 31 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 41 1 0 0 0 0 27 29 1 0 0 0 0 27 42 1 0 0 0 0 28 30 1 0 0 0 0 28 43 1 0 0 0 0 29 32 1 0 0 0 0 29 44 1 0 0 0 0 30 45 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 34 35 2 0 0 0 0 34 52 1 0 0 0 0 35 36 1 0 0 0 0 35 57 1 0 0 0 0 M END > DB02421 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/HSCJRCZFDFQWRP-NYYOCOOHSA-N/SDF?record_type=3d > [H]N1C(=O)C=CN([C@@H]2O[C@H](COP(O)(=O)OP(O)(=O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C1=O > InChI=1S/C15H24N2O17P2/c18-3-5-8(20)10(22)12(24)14(32-5)33-36(28,29)34-35(26,27)30-4-6-9(21)11(23)13(31-6)17-2-1-7(19)16-15(17)25/h1-2,5-6,8-14,18,20-24H,3-4H2,(H,26,27)(H,28,29)(H,16,19,25)/t5-,6-,8-,9-,10+,11-,12+,13-,14-/m1/s1 > HSCJRCZFDFQWRP-NYYOCOOHSA-N > C15H24N2O17P2 > 566.3018 > 566.055020376 > 14 > 60 > 46.17851463048488 > 0 > 9 > 0 > 0 > {[(2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[hydroxy({[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})phosphoryl]oxy})phosphinic acid > -1.43 > -4.996608078666667 > -1.58 > 1 > 3 > -2 > 3.176325128018932 > 1.7326003066859688 > -3.64840938010819 > 291.53999999999996 > 106.45579999999997 > 9 > 0 > 1.50e+01 g/l > uridine-5'-diphosphate-mannose > 0 $$$$