HMDB0248788 RDKit 3D {4-[4-(6-Carbamoyl-3,5-dimethylpyrazin-2-yl)phenyl]cyclohexyl}acetic acid 52 54 0 0 0 0 0 0 0 0999 V2000 7.5066 0.3677 0.2898 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0112 0.3036 0.2354 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2988 1.0889 1.1108 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9334 1.0510 1.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1597 1.9087 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2701 0.2488 0.2016 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8291 0.2127 0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2463 0.3361 -1.1057 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1202 0.3002 -1.2654 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9737 0.1424 -0.1964 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4227 0.1130 -0.4383 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 1.2010 0.3045 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6292 0.8088 0.3865 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0378 -0.0635 -0.7633 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5152 -0.0738 -0.8944 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2867 -0.5661 0.2319 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5402 -0.5419 0.1816 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6874 -1.0647 1.3662 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3968 -1.4133 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9982 -1.2259 -0.0279 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4039 0.0209 1.0483 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9741 0.0577 1.2025 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9939 -0.4992 -0.6329 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3613 -0.4993 -0.6464 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0603 -1.3533 -1.5957 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4582 -1.4462 -1.6945 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3347 -2.0713 -2.3981 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9021 0.6402 -0.6777 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9610 -0.5650 0.6578 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8117 1.1936 1.0094 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7751 2.8241 2.2006 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0882 1.4100 3.0113 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1513 2.1499 1.6791 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8928 0.4630 -1.9778 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5114 0.4020 -2.2795 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6245 0.2290 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7655 1.2254 1.3534 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0316 2.1856 -0.1423 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8153 0.2531 1.3273 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 1.7067 0.3976 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 0.3747 -1.7356 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8254 -0.6168 -1.8322 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8560 0.9856 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1417 -0.9289 2.2631 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3867 -1.9955 -1.5408 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9549 -2.0250 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -2.0183 -0.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9509 -1.3230 1.0662 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0537 -0.1036 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4102 -0.0493 2.1979 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0022 -2.0815 -1.0793 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9742 -0.8860 -2.4053 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 1 0 4 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 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 14 19 1 0 19 20 1 0 10 21 1 0 21 22 2 0 6 23 1 0 23 24 2 0 24 25 1 0 25 26 1 0 25 27 2 0 24 2 1 0 22 7 1 0 20 11 1 0 1 28 1 0 1 29 1 0 1 30 1 0 5 31 1 0 5 32 1 0 5 33 1 0 8 34 1 0 9 35 1 0 11 36 1 0 12 37 1 0 12 38 1 0 13 39 1 0 13 40 1 0 14 41 1 0 15 42 1 0 15 43 1 0 18 44 1 0 19 45 1 0 19 46 1 0 20 47 1 0 20 48 1 0 21 49 1 0 22 50 1 0 26 51 1 0 26 52 1 0 M END