HMDB0030512 RDKit 3D Momoridcin 84 88 0 0 0 0 0 0 0 0999 V2000 2.1423 -1.1072 3.3221 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3325 -0.8985 2.0271 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3606 -0.4312 1.1849 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7363 0.8030 1.7575 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4375 1.1986 1.3107 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1093 0.4157 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5165 0.9690 0.0623 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2778 2.2885 -0.7164 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0943 1.3817 1.3555 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5501 1.1452 1.5636 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1987 0.2067 0.6494 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0111 -0.5943 1.0251 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7912 0.3049 -0.7747 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2864 1.5981 -1.3465 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4417 -0.8051 -1.6073 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3207 0.1100 -0.8357 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0818 -1.3708 -0.7669 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6178 -1.7395 -0.6597 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0347 -1.0495 0.5566 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8501 -1.5047 1.7171 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4063 -1.4564 0.7711 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3401 -2.7029 1.6546 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9641 -2.0637 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4405 -2.2973 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1946 -0.9591 -0.4955 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4316 -0.8232 -2.0039 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1219 0.3155 -2.3502 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4989 -1.0184 0.1845 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1648 0.2977 0.4197 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2845 1.4335 0.7317 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9912 2.7284 0.3631 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 1.4083 0.2959 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7276 2.4318 -0.8501 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2408 0.0990 -0.0159 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8085 -0.1172 3.7849 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6569 -1.9493 3.7574 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2128 -1.1632 3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1707 1.4005 2.5555 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9045 2.1068 1.7212 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6765 0.5338 -0.7525 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8542 3.1260 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2276 2.6009 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5847 2.2057 -1.7639 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9697 2.5003 1.5542 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5206 0.9918 2.2505 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 2.0893 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7244 0.7675 2.6147 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9535 1.7074 -2.4066 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1189 2.4749 -0.7209 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4111 1.4900 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4973 -1.7530 -1.0735 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9747 -0.8326 -2.5924 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5027 -0.4582 -1.7818 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0356 0.3758 -1.9052 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3974 -1.8206 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -1.9133 -0.0589 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5609 -2.8295 -0.6186 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1802 -1.3455 -1.6252 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9333 -1.2503 1.6508 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9028 -2.6350 1.6526 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5369 -1.1378 2.7043 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3281 -3.1570 1.8461 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1563 -2.5702 2.6036 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1765 -3.5046 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7999 -1.4389 -1.4081 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4667 -3.0180 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7759 -2.7526 0.5322 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -2.9892 -1.2156 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0401 -1.6859 -2.3782 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -0.9182 -2.5519 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5807 0.1769 -3.1932 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3929 -1.5347 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1584 -1.6993 -0.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 0.5384 -0.5367 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9827 0.2080 1.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2482 1.4838 1.8701 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7974 2.8580 1.1444 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3571 3.6079 0.4341 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 2.6333 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2187 1.8969 1.0839 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2443 3.3738 -0.4947 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6757 2.7364 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1021 1.9804 -1.6471 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5799 0.2956 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 13 15 1 0 13 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 25 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 32 34 1 0 21 3 1 0 34 25 1 0 34 3 1 0 19 6 1 0 16 7 1 0 1 35 1 0 1 36 1 0 1 37 1 0 4 38 1 0 5 39 1 0 6 40 1 0 8 41 1 0 8 42 1 0 8 43 1 0 9 44 1 0 9 45 1 0 10 46 1 0 10 47 1 0 14 48 1 0 14 49 1 0 14 50 1 0 15 51 1 0 15 52 1 0 15 53 1 0 16 54 1 0 17 55 1 0 17 56 1 0 18 57 1 0 18 58 1 0 20 59 1 0 20 60 1 0 20 61 1 0 22 62 1 0 22 63 1 0 22 64 1 0 23 65 1 0 23 66 1 0 24 67 1 0 24 68 1 0 26 69 1 0 26 70 1 0 27 71 1 0 28 72 1 0 28 73 1 0 29 74 1 0 29 75 1 0 30 76 1 0 31 77 1 0 31 78 1 0 31 79 1 0 32 80 1 0 33 81 1 0 33 82 1 0 33 83 1 0 34 84 1 0 M END