HMDB0272207 RDKit 3D PG(i-24:0/20:4(5Z,8Z,11Z,13E)-OH(15S)) 153152 0 0 0 0 0 0 0 0999 V2000 2.5766 0.8206 2.4716 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1457 -0.4772 1.7734 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0946 -0.1756 0.7171 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 0.4801 1.3812 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1469 0.7759 0.3071 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3833 1.4808 0.8200 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0126 0.6808 1.7276 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3239 1.8401 -0.2773 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2183 1.2595 -1.5038 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1131 1.5812 -2.5868 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9432 0.9463 -3.7666 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8491 -0.0270 -3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8477 0.1586 -4.9016 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4295 -0.8005 -5.6899 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9647 -2.2200 -5.5724 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7591 -2.9489 -5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7204 -3.5518 -3.8807 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8672 -3.5457 -2.9941 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2414 -4.9618 -2.4883 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0797 -5.4536 -1.5995 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -4.4305 -0.4932 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2105 -3.4442 -0.6676 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5992 -4.5399 0.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4164 -3.4758 1.7033 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7990 -4.1090 2.9281 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -3.4197 3.9527 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5543 -2.4860 4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6842 -1.9274 4.8507 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4197 -2.1345 5.9133 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7228 -0.8084 6.4089 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1615 0.1503 6.9998 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1636 0.9772 6.2987 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5034 1.8856 5.2879 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5093 2.8870 4.7276 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7763 3.7592 3.7313 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5567 4.8976 3.1709 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6563 5.5986 2.1011 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4742 4.7187 0.9344 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5467 5.2957 -0.0569 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5641 4.4085 -1.2649 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6298 4.6378 -2.2853 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3526 3.7125 -3.4539 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4137 3.6302 -4.4824 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6364 3.0039 -3.8542 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7798 2.7534 -4.7718 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8440 2.0160 -3.9121 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0424 1.6726 -4.7361 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0698 0.9465 -3.9463 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6745 -0.3479 -3.3305 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1860 -1.3864 -4.3187 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8281 -0.3004 -2.1117 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -2.9431 2.0091 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3786 -2.5811 0.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -2.1247 1.1383 P 0 0 0 0 0 5 0 0 0 0 0 0 -5.7968 -3.4052 1.1474 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9817 -1.4018 2.6515 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5850 -1.0423 0.0029 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3008 -1.8397 -0.9195 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9517 -1.0117 -1.9949 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.6270 -1.9023 -2.8368 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0125 -0.1216 -1.3545 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4251 0.8014 -0.4788 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2297 0.8704 3.4995 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2366 1.6994 1.8702 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6812 0.9228 2.4982 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -0.8616 1.2871 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8051 -1.2269 2.4849 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8234 -1.1193 0.2512 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5602 0.4908 -0.0169 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2565 1.3391 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5244 -0.2335 2.1522 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5086 -0.2362 -0.0187 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7006 1.3812 -0.4665 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1344 2.4282 1.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3281 1.1979 2.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1053 2.5618 -0.1709 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 0.5663 -1.5433 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9055 2.2932 -2.5143 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6021 1.1693 -4.5862 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4231 -0.9998 -4.1847 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4167 -0.3560 -2.9208 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4456 1.1850 -4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6788 -0.5714 -6.4417 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -2.3075 -5.1069 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0345 -2.5309 -6.6818 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1059 -2.9730 -5.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1913 -4.0694 -3.5731 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8634 -2.9012 -2.1277 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7842 -3.2315 -3.5923 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1403 -4.9359 -1.8775 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3891 -5.5955 -3.3642 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3773 -6.4152 -1.1698 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2057 -5.5261 -2.2227 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7954 -2.7384 1.2914 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5665 -4.9224 3.2271 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0561 -4.7965 2.5281 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -2.8194 6.8354 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4395 -2.5762 5.5685 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3852 -0.3223 5.5834 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5807 -0.9731 7.1915 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 0.8646 7.6981 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7768 -0.4153 7.8052 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5766 1.6875 7.0861 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0513 0.4931 5.8906 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0983 1.3351 4.4242 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 2.4613 5.7703 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8585 3.4934 5.5855 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4057 2.4042 4.3096 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2867 3.2018 2.9487 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0988 4.1805 4.3517 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7931 5.6139 3.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4858 4.5459 2.7238 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2573 5.8513 2.6316 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2137 6.5072 1.8181 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1956 3.6692 1.1191 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4717 4.6499 0.4042 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5469 5.2878 0.3992 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1989 6.3287 -0.2705 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5754 3.3443 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 4.4953 -1.7382 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6204 4.5312 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5343 5.6735 -2.6869 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4499 4.1766 -3.9654 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0837 2.6965 -3.0673 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7046 4.6384 -4.8687 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 3.0465 -5.3703 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4163 2.1125 -3.2467 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0043 3.7886 -3.1219 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5374 2.0694 -5.6214 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2569 3.6600 -5.1674 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3882 1.0695 -3.5439 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1157 2.6205 -3.0296 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7859 1.0819 -5.6583 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5318 2.5986 -5.1686 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9618 0.7307 -4.6062 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4974 1.5764 -3.1337 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6795 -0.8022 -2.9787 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0982 -2.3485 -3.7734 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9287 -1.5463 -5.1173 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1759 -1.1600 -4.7078 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8381 -0.8260 -2.2474 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7199 0.6969 -1.6452 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3030 -0.9254 -1.2849 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6563 -1.9413 2.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4189 -3.5537 2.6446 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4324 -2.0050 3.2829 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0648 -2.3735 -0.3226 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5468 -2.5450 -1.3307 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2139 -0.4124 -2.5307 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4950 -1.5271 -3.1379 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6164 0.4387 -2.0725 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6798 -0.7721 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1733 1.2759 -0.0130 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 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 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 1 0 41 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 1 0 48 49 1 0 49 50 1 0 49 51 1 0 24 52 1 0 52 53 1 0 53 54 1 0 54 55 2 0 54 56 1 0 54 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 59 61 1 0 61 62 1 0 1 63 1 0 1 64 1 0 1 65 1 0 2 66 1 0 2 67 1 0 3 68 1 0 3 69 1 0 4 70 1 0 4 71 1 0 5 72 1 0 5 73 1 0 6 74 1 1 7 75 1 0 8 76 1 0 9 77 1 0 10 78 1 0 11 79 1 0 12 80 1 0 12 81 1 0 13 82 1 0 14 83 1 0 15 84 1 0 15 85 1 0 16 86 1 0 17 87 1 0 18 88 1 0 18 89 1 0 19 90 1 0 19 91 1 0 20 92 1 0 20 93 1 0 24 94 1 6 25 95 1 0 25 96 1 0 29 97 1 0 29 98 1 0 30 99 1 0 30100 1 0 31101 1 0 31102 1 0 32103 1 0 32104 1 0 33105 1 0 33106 1 0 34107 1 0 34108 1 0 35109 1 0 35110 1 0 36111 1 0 36112 1 0 37113 1 0 37114 1 0 38115 1 0 38116 1 0 39117 1 0 39118 1 0 40119 1 0 40120 1 0 41121 1 0 41122 1 0 42123 1 0 42124 1 0 43125 1 0 43126 1 0 44127 1 0 44128 1 0 45129 1 0 45130 1 0 46131 1 0 46132 1 0 47133 1 0 47134 1 0 48135 1 0 48136 1 0 49137 1 0 50138 1 0 50139 1 0 50140 1 0 51141 1 0 51142 1 0 51143 1 0 52144 1 0 52145 1 0 56146 1 0 58147 1 0 58148 1 0 59149 1 6 60150 1 0 61151 1 0 61152 1 0 62153 1 0 M END