HMDB0060411 RDKit 3D 6-Mercaptopurine ribonucleoside triphosphate 46 48 0 0 0 0 0 0 0 0999 V2000 8.1427 2.1992 -0.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6837 1.0924 0.2350 P 0 0 0 0 0 5 0 0 0 0 0 0 9.1205 0.3662 0.8086 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8230 1.8203 1.4673 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8091 -0.0067 -0.6514 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2738 -0.3100 -0.0366 P 0 0 0 0 0 5 0 0 0 0 0 0 5.0392 -1.7987 0.1645 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9736 0.4753 1.4037 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1501 0.2260 -1.1831 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8969 1.0794 -0.4609 P 0 0 0 0 0 5 0 0 0 0 0 0 2.3074 2.1100 -1.4221 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4729 1.9494 0.8708 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7017 -0.0182 -0.0108 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4352 0.5408 -0.0707 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -0.4660 0.3379 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8923 0.0803 0.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -1.0342 0.3257 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0908 -0.7492 0.1336 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9594 -1.5731 -0.4711 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1896 -1.0268 -0.4981 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1369 0.1684 0.0929 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0871 1.1395 0.3379 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7678 0.8642 -0.1936 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6931 2.2530 0.9703 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4094 2.4122 1.3515 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4778 1.4581 1.1104 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8107 0.3317 0.4862 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1148 -1.8890 -0.7885 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4830 -3.2073 -0.6751 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6329 -1.6555 -0.6138 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0193 -2.7072 -0.0148 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2624 -0.5146 0.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3539 1.7174 2.3076 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4038 0.0725 2.1929 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 2.8359 0.5664 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4073 1.3533 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2009 0.9179 -1.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4511 -0.7895 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5414 -1.6222 1.2658 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7554 -2.5553 -0.8982 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7923 0.4269 -1.5449 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1561 3.3340 1.8578 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -1.4512 -1.7482 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8614 -3.8502 -1.0553 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1969 -1.3777 -1.5956 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -2.6218 0.9609 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 2 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 6 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 10 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 22 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 17 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 30 15 1 0 27 18 1 0 27 21 1 0 3 32 1 0 4 33 1 0 8 34 1 0 12 35 1 0 14 36 1 0 14 37 1 0 15 38 1 1 17 39 1 1 19 40 1 0 23 41 1 0 25 42 1 0 28 43 1 6 29 44 1 0 30 45 1 6 31 46 1 0 M END