HMDB0060874 RDKit 3D Thioguanosine 5'-diphosphate 43 45 0 0 0 0 0 0 0 0999 V2000 6.4147 1.9616 1.2307 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7401 0.8541 0.6559 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4089 0.7985 0.5478 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7551 -0.2509 0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5192 -1.3168 -0.4646 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6757 -2.2332 -0.9577 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4346 -1.7522 -0.8017 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4686 -0.5494 -0.2202 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3516 0.2776 0.1100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4415 -0.3471 0.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7551 0.3141 0.8590 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9409 -0.6403 0.7529 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0781 0.1553 0.6628 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4954 -0.7206 0.5377 P 0 0 0 0 0 5 0 0 0 0 0 0 -5.4319 -0.4055 1.7051 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2471 -2.3787 0.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2899 -0.2209 -0.8775 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9289 0.0550 -0.5949 P 0 0 0 0 0 5 0 0 0 0 0 0 -7.5622 0.3833 -1.9326 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6370 -1.3354 0.0483 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1965 1.3529 0.4355 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7411 1.1343 -0.4009 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4867 2.4760 -0.0858 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4637 0.5469 -1.1124 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0642 1.4496 -1.9736 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9067 -1.2704 -0.3575 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7982 -2.5218 -0.9059 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4797 -0.1876 0.1993 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9500 2.8851 1.2663 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3761 1.8750 1.6239 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5428 -2.2881 -1.1144 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6588 1.2712 0.4753 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9432 0.9245 1.7679 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8268 -1.1738 -0.2226 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9733 -1.3652 1.5678 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0382 -2.8028 1.2795 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9870 -2.0851 0.0446 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7362 2.1509 0.0495 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6499 1.0102 -1.0131 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5667 2.6016 0.8907 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2059 -0.4108 -1.5748 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 1.9213 -2.4567 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5231 -0.1425 0.2847 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 14 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 18 21 1 0 11 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 5 26 1 0 26 27 2 0 26 28 1 0 28 2 1 0 8 4 1 0 24 9 1 0 1 29 1 0 1 30 1 0 7 31 1 0 9 32 1 1 11 33 1 1 12 34 1 0 12 35 1 0 16 36 1 0 20 37 1 0 21 38 1 0 22 39 1 6 23 40 1 0 24 41 1 6 25 42 1 0 28 43 1 0 M END