HMDB0242150 RDKit 3D N-Pentanoyl-N-{[2'-(1H-tetrazol-5-yl)biphenyl-4-yl]methyl}-L-valine 61 63 0 0 0 0 0 0 0 0999 V2000 -4.7689 2.7770 -1.8308 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6595 1.7485 -2.9155 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3503 0.9676 -2.8478 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3067 0.2746 -1.4981 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0871 -0.5141 -1.3115 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3764 -0.6867 -2.3764 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6039 -1.1018 -0.1364 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3639 -1.8827 -0.2268 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8641 -1.1385 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9148 -1.7880 0.7196 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0929 -1.1365 0.9903 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3292 0.1707 0.6285 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5851 0.8447 0.9219 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7504 1.4943 2.1523 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 2.1356 2.4629 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9371 2.1476 1.5621 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7697 1.4967 0.3307 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6138 0.8536 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4126 0.1720 -1.2582 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3058 0.0809 -2.2606 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7504 -0.6065 -3.2218 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 -0.9735 -2.8951 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3202 -0.4920 -1.6834 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3147 0.8226 -0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 0.1616 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1882 -1.0359 1.1752 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1385 0.3240 1.7009 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6908 0.6306 2.8147 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5096 1.3748 1.0683 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5565 -1.6386 1.2949 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9921 -1.4788 2.7545 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5684 -3.1142 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3256 3.6489 -2.2245 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7588 3.0869 -1.4906 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 2.3278 -0.9812 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5249 1.0622 -2.8311 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 2.2513 -3.9005 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4819 1.6306 -3.0193 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3732 0.2337 -3.6766 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2038 -0.4116 -1.5218 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4803 0.9521 -0.6605 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -2.7798 0.4575 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3443 -2.3478 -1.2536 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7457 -2.8230 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8922 -1.6483 1.5111 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9072 1.4599 2.8418 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9696 2.6170 3.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8537 2.6538 1.8082 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5944 1.5288 -0.3471 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9062 -1.5230 -3.5043 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4383 1.8634 -0.3488 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3266 0.7006 -0.8339 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5442 -1.6488 1.8935 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6777 2.3476 1.2601 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3385 -1.1208 0.7086 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1488 -1.5606 3.4558 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6504 -2.3659 2.9927 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6505 -0.6082 2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0744 -3.6397 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2049 -3.3524 -0.0168 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6538 -3.4243 1.0010 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 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 12 24 1 0 24 25 2 0 7 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 26 30 1 0 30 31 1 0 30 32 1 0 25 9 1 0 18 13 1 0 23 19 2 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 0 2 37 1 0 3 38 1 0 3 39 1 0 4 40 1 0 4 41 1 0 8 42 1 0 8 43 1 0 10 44 1 0 11 45 1 0 14 46 1 0 15 47 1 0 16 48 1 0 17 49 1 0 22 50 1 0 24 51 1 0 25 52 1 0 26 53 1 0 29 54 1 0 30 55 1 0 31 56 1 0 31 57 1 0 31 58 1 0 32 59 1 0 32 60 1 0 32 61 1 0 M END