HMDB0001379 RDKit 3D Diguanosine triphosphate 78 83 0 0 0 0 0 0 0 0999 V2000 10.9140 2.2008 -0.7639 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5921 0.8236 -0.6523 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4759 -0.1697 -0.7244 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1215 -1.4702 -0.6036 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9678 -2.3877 -0.6794 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7914 -1.7630 -0.3963 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0836 -2.9181 -0.2136 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 -2.5957 -0.0288 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6220 -1.2594 -0.0841 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4629 -0.4979 0.1597 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8063 0.1280 -0.8858 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9848 0.9493 -0.1518 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7456 1.5190 -0.6504 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8841 0.3986 -0.9618 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7539 0.2957 0.3039 P 0 0 0 0 0 5 0 0 0 0 0 0 2.1528 1.2175 1.4405 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9123 -1.3487 0.8397 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2002 0.5632 -0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 1.9832 0.5387 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.3705 2.0338 2.0383 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2743 3.3500 -0.1497 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0921 1.9831 0.1273 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5535 0.5008 -0.5361 P 0 0 0 0 0 5 0 0 0 0 0 0 -3.2223 0.8563 -1.8752 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2959 -0.5206 -0.9139 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6937 -0.1985 0.4959 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -1.4324 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1753 -2.0218 0.8765 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2349 -1.1764 1.0292 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2210 -1.4293 0.0871 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.3229 -0.2694 -0.7649 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4515 0.0769 -1.7211 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8501 1.2679 -2.2618 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9551 1.6312 -1.6324 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7594 2.7407 -1.8142 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4519 3.6019 -2.6785 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8455 2.8205 -1.0269 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1673 1.8884 -0.1015 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3564 2.0342 0.6828 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3708 0.8310 0.0519 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2701 0.6953 -0.7021 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9366 -2.7354 -0.5333 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.0217 -3.6037 -0.3262 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7149 -3.2733 0.1908 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0052 -4.2474 1.1032 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9771 1.7678 0.6062 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4543 2.5671 1.5859 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7203 0.5631 1.2439 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9951 0.2443 2.4116 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8739 -0.7486 -0.3209 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2785 0.5042 -0.4491 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8541 2.5467 -0.5283 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1957 2.8802 -1.0918 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9670 -3.3064 0.1533 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6811 -1.1842 0.6214 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6327 0.1905 0.7253 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9541 1.9575 -1.6896 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2921 2.2767 -0.0679 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8884 -1.3705 1.8055 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0622 3.3039 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -1.3024 -0.3204 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1644 -2.1408 0.3119 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1519 -1.5976 -1.0215 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7701 -2.3134 1.8434 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1941 -1.5059 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5905 -0.4072 -2.1026 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9176 1.1613 0.9055 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7213 2.9196 1.0387 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6120 0.1200 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7804 -2.6585 -1.6124 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8758 -4.4754 -0.7415 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9639 -3.5675 -0.5723 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4960 -3.8241 1.8474 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5912 2.2995 -0.1209 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4738 2.6534 1.5261 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7351 0.7357 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -0.6459 2.2707 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5785 1.2847 -0.4229 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 4 6 1 0 6 7 1 0 7 8 2 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 1 0 15 16 2 0 15 17 1 0 15 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 19 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 23 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 2 0 33 34 1 0 34 35 1 0 35 36 2 0 35 37 1 0 37 38 2 0 38 39 1 0 38 40 1 0 40 41 1 0 30 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 12 46 1 0 46 47 1 0 46 48 1 0 48 49 1 0 9 50 1 0 50 51 1 0 51 2 1 0 50 6 2 0 48 10 1 0 44 28 1 0 41 31 1 0 41 34 2 0 1 52 1 0 1 53 1 0 8 54 1 0 10 55 1 1 12 56 1 1 13 57 1 0 13 58 1 0 17 59 1 0 21 60 1 0 25 61 1 0 27 62 1 0 27 63 1 0 28 64 1 1 30 65 1 1 32 66 1 0 39 67 1 0 39 68 1 0 40 69 1 0 42 70 1 6 43 71 1 0 44 72 1 6 45 73 1 0 46 74 1 6 47 75 1 0 48 76 1 1 49 77 1 0 51 78 1 0 M END