HMDB0001340 RDKit 3D Diguanosine tetraphosphate 83 88 0 0 0 0 0 0 0 0999 V2000 10.8990 -3.0048 0.9429 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9398 -1.7800 0.1882 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8784 -0.9601 0.1449 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9627 0.1755 -0.5698 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1316 0.4673 -1.2415 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9109 1.6524 -1.8405 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6562 2.0806 -1.5466 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0511 1.1699 -0.7552 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7703 1.3255 -0.2123 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1015 0.1668 0.2103 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0444 0.8289 0.9172 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9689 -0.1309 1.3333 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 -0.7201 0.2178 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2221 -1.8027 0.6923 P 0 0 0 0 0 5 0 0 0 0 0 0 3.8748 -2.9078 1.5075 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5639 -2.4628 -0.7427 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9717 -1.1059 1.5691 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4843 0.3409 0.9044 P 0 0 0 0 0 5 0 0 0 0 0 0 1.7788 1.5194 1.8296 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1859 0.5975 -0.6061 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2013 0.3888 0.6782 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8564 -1.1479 0.7212 P 0 0 0 0 0 5 0 0 0 0 0 0 0.1161 -2.2439 1.0117 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0682 -1.2659 1.9223 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4933 -1.4212 -0.8408 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1187 -1.6560 -0.7971 P 0 0 0 0 0 5 0 0 0 0 0 0 -3.5155 -2.0725 0.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4926 -2.9886 -1.8414 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0928 -0.3560 -1.2304 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7591 0.1112 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1172 -0.3669 -0.2483 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1691 -0.2128 0.5928 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0251 -1.2496 0.0574 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.3929 -0.9212 0.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3899 -1.7784 0.5716 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5284 -1.0340 0.7539 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2006 0.2833 0.6396 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9569 1.4531 0.7391 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1833 1.3788 0.9724 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3182 2.6525 0.5772 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0047 2.6582 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3288 3.8965 0.1988 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2700 1.5358 0.2323 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8578 0.3401 0.3858 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8771 -1.1513 -1.4557 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.4106 -2.3574 -1.9618 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7497 -0.0990 -1.5903 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9107 -0.3740 -2.6593 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 1.9126 -0.0157 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6388 3.1284 0.6675 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6887 1.9090 -1.0948 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9319 3.1969 -1.5156 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2212 -0.3809 -1.1909 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2824 -0.0938 -1.8049 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1055 -1.5098 -0.4642 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0083 -3.3242 1.3712 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7403 -3.5994 1.0843 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2404 3.0065 -1.9079 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7841 1.9654 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5668 1.2298 1.8211 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2088 0.4348 1.8761 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4460 -0.9066 1.9845 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2917 -3.3842 -0.6171 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1539 1.5804 -0.7552 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2385 -0.3343 2.2154 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8214 -3.7133 -1.2552 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 1.2433 -0.1572 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2197 -0.0918 0.8694 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0338 -1.5682 -0.2761 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6385 -2.1661 0.4888 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3412 -2.8541 0.6106 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8768 3.5371 0.6439 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5310 3.9692 -0.4649 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5649 4.7710 0.7335 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7830 -0.7880 -1.9638 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1990 -3.0443 -1.2496 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2366 0.8693 -1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8128 0.4469 -3.2095 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5841 1.7541 -0.4557 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1844 3.0435 1.4893 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3530 1.2050 -1.8583 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5433 3.3034 -2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8906 -2.1988 -0.3962 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 21 22 1 0 22 23 2 0 22 24 1 0 22 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 26 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 2 0 36 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 41 43 2 0 43 44 1 0 33 45 1 0 45 46 1 0 45 47 1 0 47 48 1 0 11 49 1 0 49 50 1 0 49 51 1 0 51 52 1 0 5 53 1 0 53 54 2 0 53 55 1 0 55 2 1 0 8 4 1 0 51 9 1 0 47 31 1 0 44 34 1 0 44 37 2 0 1 56 1 0 1 57 1 0 7 58 1 0 9 59 1 1 11 60 1 1 12 61 1 0 12 62 1 0 16 63 1 0 20 64 1 0 24 65 1 0 28 66 1 0 30 67 1 0 30 68 1 0 31 69 1 6 33 70 1 1 35 71 1 0 40 72 1 0 42 73 1 0 42 74 1 0 45 75 1 6 46 76 1 0 47 77 1 1 48 78 1 0 49 79 1 6 50 80 1 0 51 81 1 6 52 82 1 0 55 83 1 0 M END