HMDB0010348 RDKit 3D Dehydroepiandrosterone 3-glucuronide 69 73 0 0 0 0 0 0 0 0999 V2000 5.1173 -1.4858 -0.6421 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1304 -0.2219 0.1979 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4002 -0.3525 1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1233 0.3803 1.6073 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3604 0.6854 0.3906 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1506 0.5010 -0.9057 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4522 1.3301 -1.9561 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0728 0.7841 -2.0724 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4466 0.1760 -1.0799 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.3259 -1.3177 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8553 0.4108 -0.3737 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6491 -0.4860 0.3114 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9794 -0.2510 -0.0308 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6407 0.0894 1.1715 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8610 0.6246 0.7974 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5039 1.2575 1.9732 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6340 1.8117 1.8555 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8938 1.2598 3.2165 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7396 -0.4621 0.2844 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.5046 0.0855 -0.7713 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0439 -1.6651 -0.2323 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.1628 -2.6788 0.7449 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 -1.5021 -0.5467 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4567 -1.5068 -1.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0824 1.2793 0.5765 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0407 0.5523 1.2648 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0382 -0.0371 0.2702 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1606 -1.5058 0.6177 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5322 0.9442 -0.6068 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4890 1.0543 -1.7224 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8482 0.7472 -1.0764 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5223 0.2471 0.2906 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2284 0.2203 1.2793 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4256 -2.2547 -0.2412 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1432 -1.9387 -0.6168 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8817 -1.3166 -1.6912 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2182 -1.4545 1.6488 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -0.0733 2.3051 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4543 -0.2147 2.2996 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3361 1.3146 2.2093 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0956 1.7858 0.3918 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0647 -0.5563 -1.1677 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9965 1.3153 -2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3732 2.3669 -1.5637 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5574 0.8904 -3.0161 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0212 -1.4139 -1.1265 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2093 -0.1843 -2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4752 1.0942 -1.0252 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 0.5893 -0.7601 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6754 1.4202 0.0343 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 2.1059 3.5982 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5062 -0.7312 1.0658 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3087 -0.4890 -0.9563 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6091 -2.0749 -1.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3286 -2.7807 1.2661 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9767 -2.3742 -0.2005 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0118 -2.2745 -2.2902 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7057 2.2001 0.0472 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 1.6420 1.3517 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3941 -0.1952 1.9279 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5539 1.3049 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3571 -2.1117 0.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0879 -1.6201 1.7381 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -1.8603 0.2154 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5677 1.8429 0.0369 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5324 2.1352 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2997 0.4558 -2.6073 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5048 1.6213 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2729 -0.1258 -1.6419 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 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 1 0 16 17 2 0 16 18 1 0 15 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 11 25 1 0 25 26 1 0 26 27 1 0 27 28 1 1 6 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 2 0 29 2 1 0 32 2 1 0 27 5 1 0 27 9 1 0 23 13 1 0 1 34 1 0 1 35 1 0 1 36 1 0 3 37 1 0 3 38 1 0 4 39 1 0 4 40 1 0 5 41 1 1 6 42 1 6 7 43 1 0 7 44 1 0 8 45 1 0 10 46 1 0 10 47 1 0 11 48 1 6 13 49 1 6 15 50 1 6 18 51 1 0 19 52 1 1 20 53 1 0 21 54 1 6 22 55 1 0 23 56 1 1 24 57 1 0 25 58 1 0 25 59 1 0 26 60 1 0 26 61 1 0 28 62 1 0 28 63 1 0 28 64 1 0 29 65 1 1 30 66 1 0 30 67 1 0 31 68 1 0 31 69 1 0 M END