Mrv1652306242117183D 33 34 0 0 0 0 999 V2000 5.2777 -0.4985 0.6755 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9107 -0.3732 1.2122 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7761 -0.4689 2.4828 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7732 -0.1566 0.3917 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8886 -0.0535 -0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0325 -0.1500 -1.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7624 0.1607 -1.7465 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5482 0.2580 -1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4461 0.1515 0.2351 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8623 0.2629 0.8466 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5512 1.5083 0.3811 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8254 0.9596 -0.2283 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8896 1.8403 -0.0672 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0043 -0.2988 0.5960 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9620 -1.2598 -0.0507 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.9209 -2.4630 0.6428 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6867 -0.8102 0.5654 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5411 -0.0531 0.9811 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4583 -0.1538 2.2368 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3235 -1.3845 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0167 -0.6642 1.5174 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6297 0.3698 0.0942 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8756 0.2410 -2.8146 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3404 0.4202 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7412 0.3183 1.9575 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8505 2.1442 1.2343 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9782 2.0645 -0.3864 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6918 0.7190 -1.2979 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0036 2.3137 -0.9283 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3021 -0.0116 1.6165 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6895 -1.3633 -1.1178 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9823 -0.8472 0.0873 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9782 -2.7219 0.8083 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 14 17 1 0 0 0 0 9 18 1 0 0 0 0 18 19 2 0 0 0 0 18 4 1 0 0 0 0 17 10 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 7 23 1 0 0 0 0 8 24 1 0 0 0 0 10 25 1 1 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 28 1 6 0 0 0 13 29 1 0 0 0 0 14 30 1 1 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 M END > NP0015296 > NP-MRD > [H]OC([H])([H])[C@@]1([H])O[C@@]([H])(N2C([H])=C([H])C(=O)N(C(=O)C([H])([H])[H])C2=O)C([H])([H])[C@]1([H])O[H] > InChI=1S/C11H14N2O6/c1-6(15)13-9(17)2-3-12(11(13)18)10-4-7(16)8(5-14)19-10/h2-3,7-8,10,14,16H,4-5H2,1H3/t7-,8+,10+/m0/s1 > VDXVWUDUXDCDAI-QXFUBDJGSA-N > C11H14N2O6 > 270.241 > 270.085186179 > 6 > 33 > 25.539852929138796 > 1 > 2 > 0 > 0 > 3-acetyl-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione > -1.07 > -1.5259957729999996 > -0.44 > 0 > 2 > 0 > 14.787555376995655 > 13.894924404367341 > -2.9780835901431573 > 107.38000000000002 > 60.6208 > 2 > 1 > 9.83e+01 g/l > 3-acetyl-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione > 0 > NP0015296 > 3-acetyl-2′-deoxyuridine $$$$