HMDB0034290 RDKit 3D 1,28-Octacosanediol 88 87 0 0 0 0 0 0 0 0999 V2000 -10.8477 2.3816 1.9468 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0611 3.3499 1.3821 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2165 2.9333 0.2427 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1696 1.8927 0.4965 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7674 0.6085 0.9537 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8498 -0.5178 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0439 -1.1410 0.1788 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0402 -0.3703 -0.5918 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 0.3018 0.2519 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0176 1.0690 -0.5979 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3111 0.1096 -1.5457 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3245 0.9330 -2.3784 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6135 0.0281 -3.3256 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8527 -1.0400 -2.5951 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.3934 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8986 -1.5596 -0.9932 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9452 -1.0035 -0.0705 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6642 -2.1198 0.6538 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3404 -3.0402 -0.3003 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0959 -4.1715 0.2334 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2689 -4.0547 1.1022 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4908 -3.3759 0.6254 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4675 -1.9164 0.3731 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2351 -1.2273 1.7112 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1507 0.2487 1.5306 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4310 0.7696 0.9359 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3136 2.2887 0.7709 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6040 2.7598 0.1757 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5546 4.2518 -0.0107 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3613 4.8347 1.2401 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4517 1.9962 1.2823 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4595 3.8654 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7716 4.1349 0.9856 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9139 2.4851 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7734 3.8046 -0.3117 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5365 1.8295 -0.4091 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4317 2.2725 1.2864 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3845 0.8036 1.8955 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5703 0.3477 0.2019 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2108 -0.2687 2.1449 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4962 -1.3594 1.6644 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7719 -1.6634 -0.5325 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5385 -2.0479 0.6573 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4978 -1.2100 -1.2136 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4293 0.2503 -1.3989 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4217 -0.5173 0.7476 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4787 0.9281 1.0057 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5869 1.7849 -1.2549 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3184 1.6479 0.0015 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8197 -0.7076 -0.9926 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0104 -0.3468 -2.2699 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 1.4945 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 1.7301 -2.9296 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3362 -0.4369 -4.0331 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8523 0.6341 -3.8773 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -1.7530 -2.0586 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3215 -1.6898 -3.3635 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9158 0.1913 -2.2488 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2919 0.2541 -0.9376 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1533 -2.1174 -0.4023 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3391 -2.2085 -1.7797 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6876 -0.4335 -0.7015 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5346 -0.2512 0.6243 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9174 -2.7226 1.2419 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3697 -1.6197 1.3428 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8061 -2.4409 -1.1101 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4649 -3.5412 -0.8918 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 -4.8713 0.7177 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3965 -4.8026 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0142 -3.6931 2.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6002 -5.1320 1.3286 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2660 -3.5288 1.4542 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9705 -3.9437 -0.2268 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7929 -1.6034 -0.4104 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4960 -1.6272 0.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4201 -1.7122 2.2367 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1477 -1.4341 2.3693 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2791 0.4748 0.8706 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0074 0.7287 2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5532 0.3960 -0.1173 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2681 0.4781 1.5771 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4415 2.4671 0.1282 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1740 2.6770 1.8133 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4265 2.4655 0.8688 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7100 2.2355 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4912 4.6559 -0.4498 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7151 4.4974 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1639 5.3238 1.5124 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 1 0 6 7 1 0 7 8 1 0 8 9 1 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 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 1 31 1 0 2 32 1 0 2 33 1 0 3 34 1 0 3 35 1 0 4 36 1 0 4 37 1 0 5 38 1 0 5 39 1 0 6 40 1 0 6 41 1 0 7 42 1 0 7 43 1 0 8 44 1 0 8 45 1 0 9 46 1 0 9 47 1 0 10 48 1 0 10 49 1 0 11 50 1 0 11 51 1 0 12 52 1 0 12 53 1 0 13 54 1 0 13 55 1 0 14 56 1 0 14 57 1 0 15 58 1 0 15 59 1 0 16 60 1 0 16 61 1 0 17 62 1 0 17 63 1 0 18 64 1 0 18 65 1 0 19 66 1 0 19 67 1 0 20 68 1 0 20 69 1 0 21 70 1 0 21 71 1 0 22 72 1 0 22 73 1 0 23 74 1 0 23 75 1 0 24 76 1 0 24 77 1 0 25 78 1 0 25 79 1 0 26 80 1 0 26 81 1 0 27 82 1 0 27 83 1 0 28 84 1 0 28 85 1 0 29 86 1 0 29 87 1 0 30 88 1 0 M END