HMDB0001459 RDKit 3D Guanosine triphosphate adenosine 77 82 0 0 0 0 0 0 0 0999 V2000 -9.5503 -2.5819 -2.4815 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3473 -1.9926 -1.1957 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4887 -0.9698 -1.0248 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3199 -0.4346 0.2071 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0325 -0.9473 1.2709 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6922 -0.2510 2.3837 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7872 0.6797 2.0361 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5684 0.5604 0.7161 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6636 1.3614 -0.0948 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6434 0.5447 -0.5003 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4305 1.1269 -0.2433 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3645 0.0978 0.0267 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1517 0.7468 0.2821 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9128 -0.3416 0.5930 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.7968 -0.5807 2.0791 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3732 -1.8322 -0.1029 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 0.1978 -0.0729 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3162 1.6151 -0.9718 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.8708 1.4794 -1.8606 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1415 2.8943 0.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7486 1.9186 -1.8346 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9669 2.1683 -0.7069 P 0 0 0 0 0 5 0 0 0 0 0 0 2.6035 3.3364 0.1453 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3884 2.5884 -1.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3243 0.7888 0.1893 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9272 -0.1958 -0.5503 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2029 -1.3678 0.3257 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8040 -2.4376 -0.2685 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0778 -2.6181 0.3272 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9740 -1.7700 -0.3784 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9533 -1.6626 -1.7235 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8807 -0.8162 -2.1342 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5436 -0.3395 -1.0519 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5707 0.5379 -0.8674 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1592 1.1560 -1.9956 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0017 0.7951 0.3951 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4120 0.1843 1.4341 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4027 -0.6776 1.2507 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9625 -0.9471 0.0335 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7793 -2.2916 1.7338 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7776 -2.2573 2.6351 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9987 -0.9922 1.5668 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1972 -0.8202 2.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6858 2.0052 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7586 3.0311 1.0159 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0894 2.5189 0.6454 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9142 3.5670 -0.2672 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9107 -1.9922 1.1003 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5557 -2.4466 2.0977 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0470 -2.4926 -0.1394 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7909 -3.1527 -2.8941 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4390 -2.4354 -2.9797 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3468 1.3739 2.7344 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2332 1.6629 -1.0028 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0806 1.8029 -1.0502 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2233 -0.4770 -0.9103 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6739 -0.5612 0.8613 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6008 -1.7174 -1.0665 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0886 2.5719 1.0646 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9532 3.0745 -0.8787 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9115 0.2189 -0.8989 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3327 -0.5396 -1.4112 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2057 -1.7244 0.7194 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3043 -3.7092 0.1853 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2810 -2.1834 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8961 0.6644 -2.5179 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8453 2.0918 -2.2844 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8036 0.4338 2.4135 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0059 -3.0324 2.0796 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5334 -2.6925 3.4907 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6628 -0.1339 1.3639 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1734 0.1224 2.9547 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7044 1.3950 1.9092 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1976 3.1013 0.2062 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6366 2.8503 1.5246 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0586 4.4436 0.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7149 -3.2921 -0.2859 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 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 2 0 34 35 1 0 34 36 1 0 36 37 2 0 37 38 1 0 38 39 2 0 29 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 11 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 5 48 1 0 48 49 2 0 48 50 1 0 50 2 1 0 8 4 1 0 46 9 1 0 42 27 1 0 39 30 1 0 39 33 1 0 1 51 1 0 1 52 1 0 7 53 1 0 9 54 1 6 11 55 1 6 12 56 1 0 12 57 1 0 16 58 1 0 20 59 1 0 24 60 1 0 26 61 1 0 26 62 1 0 27 63 1 1 29 64 1 1 31 65 1 0 35 66 1 0 35 67 1 0 37 68 1 0 40 69 1 0 41 70 1 0 42 71 1 0 43 72 1 0 44 73 1 0 45 74 1 0 46 75 1 0 47 76 1 0 50 77 1 0 M END