HMDB0060418 RDKit 3D 6-Thioxanthine 5'-monophosphate 37 39 0 0 0 0 0 0 0 0999 V2000 -5.5481 0.7882 0.7587 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3518 1.6204 0.3166 P 0 0 0 0 0 5 0 0 0 0 0 0 -4.5477 1.9777 -1.3201 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1840 3.0093 1.2497 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9804 0.6492 0.5348 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7744 -0.0487 -0.6328 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5764 -0.9578 -0.5742 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3924 -0.2598 -0.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5052 -1.3254 -0.2301 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8258 -0.9261 0.1208 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7747 -1.7656 0.5637 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 -1.0886 0.8107 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7001 0.1985 0.5242 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4954 1.3351 0.5837 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1822 1.1967 1.1418 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9306 2.4920 0.2088 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6505 2.5534 -0.2072 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1407 3.7980 -0.5796 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8632 1.4637 -0.2722 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3735 0.2844 0.0893 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1426 -2.2018 0.8137 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1601 -3.5277 0.5034 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6215 -1.9124 0.5830 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2240 -3.0954 0.1662 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4898 2.9443 -1.4891 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 3.6220 0.7574 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6626 -0.6987 -0.7921 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6950 0.5949 -1.5196 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4232 -1.5318 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4424 -1.8720 -1.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6938 -2.8385 0.7197 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 1.4325 0.0577 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4253 4.5865 0.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1699 -1.9275 1.8438 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -3.6009 -0.4085 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0811 -1.4923 1.4919 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -3.4759 -0.5387 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 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 14 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 2 0 9 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 23 7 1 0 20 10 1 0 20 13 1 0 3 25 1 0 4 26 1 0 6 27 1 0 6 28 1 0 7 29 1 6 9 30 1 6 11 31 1 0 15 32 1 0 18 33 1 0 21 34 1 1 22 35 1 0 23 36 1 1 24 37 1 0 M END