HMDB0012895 RDKit 3D Arginine vasopressin 1-8 132135 0 0 0 0 0 0 0 0999 V2000 -4.1174 5.7717 1.7168 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5261 5.4002 0.5723 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0536 6.3793 -0.2572 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4303 3.9607 0.1805 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1061 3.3898 0.4735 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8702 1.9300 0.1725 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0801 1.5103 -1.1773 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 0.2985 -1.5317 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2944 -0.4248 -2.4268 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0346 -0.1531 -0.8577 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.0914 0.8383 -1.3264 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4150 0.6109 -0.7563 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6920 1.2130 0.4638 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9368 1.0775 1.0184 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9102 0.3333 0.3463 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6421 -0.2639 -0.8556 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3720 -0.1280 -1.4246 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3846 -1.4408 -1.3758 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4635 -2.6587 -0.6314 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6972 -3.6992 -1.2902 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2963 -2.7545 0.8105 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.1027 -3.9297 1.4174 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5203 -3.8864 1.1052 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9560 -4.8548 0.1691 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2317 -4.9239 -0.2765 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1447 -4.0132 0.1973 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4509 -4.0846 -0.2675 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7471 -3.0692 1.1033 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4469 -2.9938 1.5656 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9466 -3.0228 1.2668 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -2.6545 0.7945 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9695 -1.9557 1.6164 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -2.8830 -0.4683 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6414 -3.5845 -1.4917 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6691 -3.6310 -0.1724 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6124 -3.1538 -1.3116 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1995 -2.1033 -0.3386 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5334 -0.6932 0.5339 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2357 0.6465 -0.0063 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6659 0.4078 0.2287 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0656 -0.6974 0.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6456 1.4426 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4056 2.5314 -1.0323 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8151 3.1694 -1.1664 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1965 3.1992 0.2797 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8030 1.7530 0.6879 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0049 1.0214 0.8158 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0880 1.7479 1.0579 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3544 -0.3551 0.7574 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7796 -0.6988 0.9650 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1958 -1.7765 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6665 -2.1415 0.2032 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5373 -0.9342 -0.0976 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9303 -1.3356 0.0883 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6418 -2.2370 -0.6976 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9610 -2.1317 -0.6570 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0670 -3.2455 -1.5346 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -1.0094 2.4035 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0587 -0.9947 3.2499 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2685 -1.3184 2.8442 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7835 0.6464 -1.3491 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9868 1.6952 -1.9134 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0506 1.7631 -3.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1428 2.6777 -1.2139 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0565 3.9317 -0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3503 5.0598 -0.3889 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5769 5.4819 0.7975 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6429 5.7313 -1.1277 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3355 2.3859 0.0763 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4304 1.7066 0.6083 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2295 0.8700 1.5085 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7131 5.1199 2.4093 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8422 6.4133 -1.2717 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2884 3.4275 0.6429 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6606 3.9783 -0.9344 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3336 4.0356 0.0184 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9695 3.4734 1.6086 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5293 1.3412 0.8282 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7283 2.1192 -1.9835 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9620 -0.1041 0.2258 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7451 1.8714 -1.1436 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2006 0.7842 -2.4435 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9611 1.7863 0.9899 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2196 1.5298 1.9805 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9199 0.2078 0.7607 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3845 -0.8426 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2149 -0.6188 -2.3787 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6087 -1.4814 -2.4116 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7278 -1.8619 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6173 -4.8439 1.0324 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8980 -3.9158 2.5205 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2557 -5.6094 -0.2191 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5308 -5.6839 -1.0027 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6267 -3.5213 -1.1239 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4502 -2.3264 1.4939 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1036 -2.2596 2.2869 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9317 -3.6250 2.1744 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6693 -1.8696 -0.8605 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6425 -3.1271 -2.4414 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5571 -4.6015 -1.5485 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -3.3352 0.8691 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8892 -4.7035 -0.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -0.7267 1.6027 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4755 -0.5294 0.1834 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 1.4124 0.6676 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 3.3198 -0.6629 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1896 2.0754 -1.9974 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4472 2.5745 -1.8216 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7261 4.1799 -1.6171 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5765 3.9108 0.8228 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2563 3.3981 0.4539 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4901 1.9642 1.8164 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6713 -1.0754 0.5679 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3753 0.2290 0.7862 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9790 -1.5591 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6548 -2.7252 0.3954 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9230 -2.6125 1.1431 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9193 -2.9111 -0.5897 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2917 -0.0646 0.5254 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4111 -0.7154 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4002 -0.8740 0.9247 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5766 -2.7380 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6253 -3.0539 -2.4326 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0846 -4.2369 -1.2198 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8267 -0.7184 3.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0367 -0.1630 -1.9675 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 3.0768 -1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7649 3.5884 -0.1473 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6694 4.1679 -1.8282 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 6.3055 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1482 5.1738 -1.8339 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2975 2.8238 0.8799 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 10 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 26 28 1 0 28 29 2 0 21 30 1 0 30 31 1 0 31 32 2 0 31 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 2 0 40 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 2 3 55 57 1 0 50 58 1 0 58 59 2 0 58 60 1 0 39 61 1 0 61 62 1 0 62 63 2 0 62 64 1 0 64 65 1 0 65 66 1 0 66 67 2 3 66 68 1 0 64 69 1 0 69 70 1 0 70 71 2 0 70 6 1 0 17 12 1 0 29 23 1 0 46 42 1 0 1 72 1 0 3 73 1 0 4 74 1 0 4 75 1 0 5 76 1 0 5 77 1 0 6 78 1 1 7 79 1 0 10 80 1 1 11 81 1 0 11 82 1 0 13 83 1 0 14 84 1 0 15 85 1 0 16 86 1 0 17 87 1 0 18 88 1 0 21 89 1 1 22 90 1 0 22 91 1 0 24 92 1 0 25 93 1 0 27 94 1 0 28 95 1 0 29 96 1 0 30 97 1 0 33 98 1 0 34 99 1 0 34100 1 0 35101 1 0 35102 1 0 38103 1 0 38104 1 0 39105 1 1 43106 1 0 43107 1 0 44108 1 0 44109 1 0 45110 1 0 45111 1 0 46112 1 1 49113 1 0 50114 1 6 51115 1 0 51116 1 0 52117 1 0 52118 1 0 53119 1 0 53120 1 0 54121 1 0 56122 1 0 57123 1 0 57124 1 0 60125 1 0 61126 1 0 64127 1 0 65128 1 0 65129 1 0 67130 1 0 68131 1 0 69132 1 0 M END