HMDB0061142 RDKit 3D Fenoprofen glucuronide 52 54 0 0 0 0 0 0 0 0999 V2000 1.0455 0.7764 2.2392 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5843 -0.5608 1.6986 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6458 -0.4494 0.8979 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6771 -0.8705 -0.2863 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8239 0.1094 1.3722 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9957 0.2141 0.6054 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3208 1.5495 0.3275 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4932 1.4998 -0.4267 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6660 2.6652 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6592 2.7941 -2.0379 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7033 3.6631 -1.2853 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6266 1.3851 0.5986 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.8565 1.2714 -0.0087 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3218 0.2639 1.5605 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.2521 0.7278 2.8743 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1462 -0.5664 1.1597 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5482 -1.5964 0.3091 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -1.1949 0.9042 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1766 -2.3910 1.3227 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1621 -2.9977 0.5937 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6239 -2.4199 -0.5614 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1043 -1.2350 -0.9931 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -0.6424 -2.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 0.2491 -2.1229 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9288 -0.2338 -2.2541 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9972 0.6352 -2.2099 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8454 1.9843 -2.0387 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5534 2.4645 -1.9078 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 1.5988 -1.9511 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1129 -0.6137 -0.2701 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1308 0.6706 2.4778 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5282 0.9998 3.1754 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9803 1.5785 1.4798 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3655 -1.1876 2.5774 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -0.2326 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5138 0.5555 -1.0437 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4686 4.1228 -2.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6174 2.3448 1.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4434 0.5872 0.3476 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2242 -0.4151 1.5335 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 0.4602 3.2001 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7738 -1.0786 2.0943 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7337 -1.9573 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8272 -2.8802 2.2457 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5841 -3.9392 0.9248 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4155 -2.8765 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0715 -1.3063 -2.3914 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0117 0.2254 -2.3166 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6556 2.6942 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 3.5384 -1.7707 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4657 2.0148 -1.8437 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6879 0.3328 -0.6018 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 8 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 2 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 22 30 2 0 16 6 1 0 30 18 1 0 29 24 1 0 1 31 1 0 1 32 1 0 1 33 1 0 2 34 1 0 6 35 1 6 8 36 1 6 11 37 1 0 12 38 1 1 13 39 1 0 14 40 1 1 15 41 1 0 16 42 1 1 17 43 1 0 19 44 1 0 20 45 1 0 21 46 1 0 25 47 1 0 26 48 1 0 27 49 1 0 28 50 1 0 29 51 1 0 30 52 1 0 M END